Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 3/20 | 0.34 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.34 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.32 |
| ▸ | CRH | P06850 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.32 |
| ▸ | CDK2 | P24941 | 2/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7540765 | 0.86 | CRHR1 (0.37) | CDK1CRHR1KDM4ECDK5 | |
| SCHEMBL7570558 | 0.81 | CNR2 (0.38) | CRHR1 | |
| SCHEMBL17615377 | 0.80 | CDK2 (0.50) | CDK1KDM4ENPC1MAPTTDP1 | |
| SCHEMBL18546882 | 0.74 | ADA (0.43) | CDK1KDM4EHSP90AA1HSP90AB1CDK2 | |
| SCHEMBL21755891 | 0.74 | ADA (0.43) | CDK1KDM4EHSP90AA1HSP90AB1CDK2 | |
| SCHEMBL1913380 | 0.74 | CDK1 (0.41) | CDK1NPC1CDK5CDK2CCNA2 | |
| SCHEMBL30148781 | 0.74 | CDK1 (0.41) | CDK1NPC1CDK5CDK2CCNA2 | |
| SCHEMBL23547549 | 0.73 | CDK1 (0.50) | CDK1HSP90AA1HSP90AB1CDK2CCNB1 | |
| SCHEMBL29782919 | 0.73 | LMNA (0.38) | CDK1KDM4ENPC1CDK5CDK2 | |
| SCHEMBL23347386 | 0.72 | ADA (0.49) | CDK1KDM4ECDK2CCNB1CCNE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6448261-B1 | CORTICOTROPIN RELEASING FACTOR ANTAGONISTS; TREATING ANXIETY, DEPRESSION, AND OTHER PSYCHIATRIC AND NEUROLOGICAL DISORDERS | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2002-09-10 | — | — | US | disclosed |
| US-6107300-A | CORTICOTROPIN RELEASING FACTOR ANTAGONIST; PSYCHOLOGICAL DISORDERS | DUPONT PHARMACEUTICALS (US) | 2000-08-22 | — | — | US | disclosed |