Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.35 |
| ▸ | MAP3K6 | O95382 | 1/20 | 0.35 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 5/20 | 0.34 |
| ▸ | CDK1 | P06493 | 4/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | CCNH | P51946 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MGMT | P16455 | 2/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7626879 | 0.81 | ALDH1A1 (0.46) | ALDH1A1RXFP1KDM4EMAP3K7MAP3K6 | |
| SCHEMBL1398871 | 0.72 | ALDH1A1 (0.53) | ALDH1A1RXFP1KDM4ECDK2CDK1 | |
| SCHEMBL30514135 | 0.71 | ALDH1A1 (0.57) | ALDH1A1RXFP1KDM4ECDK2CDK1 | |
| SCHEMBL30377278 | 0.71 | ALDH1A1 (0.40) | ALDH1A1RXFP1KDM4ECDK2CDK1 | |
| SCHEMBL28339944 | 0.70 | ALDH1A1 (0.45) | ALDH1A1RXFP1KDM4EMAP3K7MAP3K6 | |
| SCHEMBL978667 | 0.69 | NOS2 (0.36) | NOS2 | |
| SCHEMBL2894579 | 0.69 | KDM4E (0.50) | ALDH1A1RXFP1KDM4ECDK2CDK1 | |
| SCHEMBL30119558 | 0.69 | ALDH1A1 (0.46) | ALDH1A1RXFP1KDM4EMAP3K7MAP3K6 | |
| SCHEMBL19728689 | 0.69 | CDK2 (0.48) | ALDH1A1RXFP1KDM4EMAP3K7MAP3K6 | |
| SCHEMBL14125940 | 0.69 | KDM4E (0.46) | ALDH1A1RXFP1KDM4ETP53CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0454651-B1 | Novel platelet-aggregation inhibitors | MONSANTO CO (US) | 1999-07-28 | — | — | EP | disclosed |
| US-5091396-A | Guanidinoalkanoylaspartylpyridine derivatives; anticoagulants | MONSANTO CO. (US) | 1992-02-25 | — | — | US | disclosed |
| EP-0454651-A2 | Novel platelet-aggregation inhibitors | MONSANTO COMPANY (US) | 1991-10-30 | — | — | EP | disclosed |
| US-5037808-A | Indolyl platelet-aggregation inhibitors | MONSANTO CO. (US) | 1991-08-06 | — | — | US | disclosed |