Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.31 |
| ▸ | PRF1 | P14222 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24733658 | 0.76 | CDK1 (0.39) | ALDH1A1CDK1MAPKAPK2TSHRPRKD1 | |
| SCHEMBL8915748 | 0.74 | GSK3B (0.43) | ALDH1A1CDK1MAPKAPK2TSHRUSP2 | |
| SCHEMBL23142246 | 0.73 | CDK1 (0.42) | ALDH1A1CDK1MAPKAPK2TSHRPRKD1 | |
| SCHEMBL23177730 | 0.73 | CDK1 (0.39) | ALDH1A1CDK1MAPKAPK2TSHRPRKD1 | |
| SCHEMBL8916133 | 0.73 | NOTUM (0.33) | ALDH1A1CDK1MAPKAPK2TSHRPRKD1 | |
| SCHEMBL3974015 | 0.66 | TSHR (0.38) | ALDH1A1CDK1MAPKAPK2TSHRPRKD1 | |
| SCHEMBL26117612 | 0.66 | PARP10 (0.34) | ALDH1A1USP2MAPK1HTTTDP1 | |
| SCHEMBL26112293 | 0.65 | USP2 (0.33) | ALDH1A1PRKD1USP2MAPK1HTT | |
| SCHEMBL13361329 | 0.63 | PARP10 (0.46) | CDK1MAPKAPK2TSHR | |
| SCHEMBL390545 | 0.63 | PARP10 (0.46) | MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5691330-A | ANTIPSYCHOTIC AGENT | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1997-11-25 | — | — | US | disclosed |
| US-5532240-A | ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1996-07-02 | — | — | US | disclosed |
| EP-0596125-A1 | CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1994-05-11 | — | — | EP | disclosed |