Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.41 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27983276 | 0.75 | TSHR (0.45) | ALDH1A1TSHRNFKB1GABRR1CYP3A4 | |
| SCHEMBL27736998 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TSHRNFKB1GABRR1CYP3A4 | |
| SCHEMBL11811837 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TSHRNFKB1GABRR1CYP3A4 | |
| SCHEMBL3844258 | 0.75 | ERCC1 (0.50) | ALDH1A1TSHRNFKB1PMP22KDM4E | |
| SCHEMBL27926108 | 0.72 | ALDH1A1 (0.40) | ALDH1A1TSHRNFKB1GABRR1CYP3A4 | |
| SCHEMBL28808887 | 0.71 | ALDH1A1 (0.39) | ALDH1A1TSHRNFKB1GABRR1CYP3A4 | |
| SCHEMBL27881202 | 0.69 | CYP1A2 (0.46) | ALDH1A1TSHRNFKB1GABRR1CYP3A4 | |
| SCHEMBL27797182 | 0.68 | TDP1 (0.38) | ALDH1A1TSHRNFKB1GABRR1CYP3A4 | |
| SCHEMBL2472805 | 0.68 | ALDH1A1 (0.50) | ALDH1A1CYP3A4MAPTHPGDCYP2C9 | |
| SCHEMBL1928760 | 0.67 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105658652-A | Compositions useful for treating disorders associated with KIT | 蓝图药品公司 | 2016-06-08 | — | — | CN | disclosed |
| CN-103391940-A | As dual activity H1Inverse agonist/5-HT2ASubstituted [ (5H-pyrrolo [2 ] s) of antagonists | LILLY CO ELI | 2013-11-13 | — | — | CN | disclosed |
| CN-101223161-A | Heteroaryl derivatives for treating viruses | GENELABS TECH INC (US) | 2008-07-16 | — | — | CN | disclosed |
| CN-101027305-A | Fused heterocyclic kinase inhibitors | BRISTOL MYERS SQUIBB CO (US) | 2007-08-29 | — | — | CN | disclosed |
| EP-0114632-B1 | 5-(4-VINYL- OR 4-ETHYNYLBENZOYL)-1,2-DIHYDRO-3H-PYRROLO-(1,2-A)-PYRROLE-1-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF | SYNTEX (U.S.A.) INC. (US) | 1987-09-16 | — | — | EP | disclosed |
| US-4560699-A | ANTIPYRETICS, ANTICOAGULANTS, VASODILAAORS, MUSCLE RELAXANTS | SYNTEX (U.S.A.) INC. (US) | 1985-12-24 | — | — | US | disclosed |
| EP-0041711-B1 | 6-CHLORO- OR 6-BROMO-1,2-DIHYDRO-3H-PYRROLO(1,2-A)-PYRROLE-1-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF, PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SYNTEX (U.S.A.) INC. (US) | 1985-04-17 | — | — | EP | disclosed |
| EP-0114632-A1 | 5-(4-Vinyl- or 4-ethynylbenzoyl)-1,2-dihydro-3H-pyrrolo-(1,2-A)-pyrrole-1-carboxylic acids and derivatives thereof | SYNTEX (U.S.A.) INC. (US) | 1984-08-01 | — | — | EP | disclosed |
| US-4344943-A | ANALGESICS, ANTIINFLAMMATORY AGENTS | SYNTEX (U.S.A.) INC. (US) | 1982-08-17 | — | — | US | disclosed |
| EP-0041711-A1 | 6-Chloro- or 6-bromo-1,2-dihydro-3H-pyrrolo(1,2-a)-pyrrole-1-carboxylic acids and derivatives thereof, process for their production and pharmaceutical compositions containing them | SYNTEX (U.S.A.) INC. (US) | 1981-12-16 | — | — | EP | disclosed |