Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | KAT2B | Q92831 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL9266933 | 0.78 | GAA (0.45) | ALDH1A1TSHRNPC1RXFP1HSD17B10 | |
| SCHEMBL9270719 | 0.76 | CYP11B1 (0.45) | ALDH1A1TSHRNPC1RXFP1HSD17B10 | |
| SCHEMBL12808519 | 0.71 | NPSR1 (0.61) | ALDH1A1TSHRHSD17B10LMNAMAPT | |
| SCHEMBL8002692 | 0.70 | GAA (0.43) | ALDH1A1TSHRNPC1GAALMNA | |
| SCHEMBL13799645 | 0.69 | TSHR (0.45) | ALDH1A1TSHRKAT2BHSD17B10LMNA | |
| SCHEMBL3988946 | 0.69 | PDGFRB (0.43) | ALDH1A1TSHRHSD17B10GAALMNA | |
| SCHEMBL7457649 | 0.68 | HTT (0.48) | ALDH1A1TSHRHSD17B10LMNAMAPT | |
| SCHEMBL4407239 | 0.67 | TSHR (0.43) | ALDH1A1TSHRHSD17B10GAALMNA | |
| SCHEMBL5992538 | 0.67 | PTGS1 (0.44) | ALDH1A1TSHRHSD17B10GAALMNA | |
| SCHEMBL5990756 | 0.67 | HSP90AB1 (0.47) | ALDH1A1TSHRHSD17B10GAALMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995013266-A1 | ACYLPYRROLE-ALKANOIC ACIDS AND INDOLE-2-ALKANOIC ACIDS PLUS THEIR DERIVATIVES FOR USE AS INHIBITORS OF PHOSPHOLIPASE A¿2? | MERCKLE GMBH CHEM.-PHARM. FABRIK (DE) | 1995-05-18 | — | — | WO | disclosed |