Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | KMO | O15229 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Isophthalic Acid SCHEMBL27902625 | 0.89 | KMO (0.49) | ALDH1A1HPGDHSD17B10KDM4EMEN1 | |
| Isophthalic Acid SCHEMBL27920422 | 0.84 | ALDH1A1 (0.51) | ALDH1A1HPGDHSD17B10KDM4EMEN1 | |
| SCHEMBL7230153 | 0.82 | USP2 (0.70) | ALDH1A1HPGDHSD17B10KDM4EGAA | |
| SCHEMBL931643 | 0.82 | MBTD1 (0.57) | ALDH1A1HSD17B10MEN1KMT2AMAPT | |
| SCHEMBL12367090 | 0.81 | ALDH1A1 (0.53) | ALDH1A1HPGDHSD17B10KDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL5227060 | 0.81 | USP2 (0.46) | ALDH1A1HPGDHSD17B10KDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL27077636 | 0.81 | USP2 (0.68) | ALDH1A1HPGDHSD17B10KDM4EGAA | |
| SCHEMBL32688379 | 0.80 | ALDH1A1 (0.80) | ALDH1A1HPGDHSD17B10KDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL17748967 | 0.80 | MBTD1 (0.55) | ALDH1A1HSD17B10MEN1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL17927700 | 0.80 | MBTD1 (0.55) | ALDH1A1HSD17B10MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105593226-A | Urea compounds and their use as FAAH enzyme inhibitors | BIAL-PORTELA & CA S A | 2016-05-18 | — | — | CN | disclosed |