Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAMK2D | Q13557 | 5/20 | 0.65 |
| ▸ | CDK2 | P24941 | 6/20 | 0.59 |
| ▸ | CDK1 | P06493 | 3/20 | 0.59 |
| ▸ | SMG1 | Q96Q15 | 3/20 | 0.59 |
| ▸ | KDR | P35968 | 2/20 | 0.59 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.55 |
| ▸ | GBA1 | P04062 | 1/20 | 0.55 |
| ▸ | ABL1 | P00519 | 1/20 | 0.52 |
| ▸ | BCR | P11274 | 1/20 | 0.52 |
| ▸ | PRKCA | P17252 | 1/20 | 0.52 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 2/20 | 0.48 |
| ▸ | CDK4 | P11802 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3949225 | 0.99 | CAMK2D (0.67) | CAMK2DCDK2CDK1SMG1KDR | |
| SCHEMBL6475220 | 0.80 | CDK1 (0.61) | CAMK2DCDK2CDK1SMG1KDR | |
| SCHEMBL4659590 | 0.78 | ROCK1 (0.56) | CAMK2DCDK2CDK1SMG1KDR | |
| Hydrochloric Acid SCHEMBL4247394 | 0.77 | ROCK1 (0.55) | CAMK2DCDK2CDK1SMG1KDR | |
| SCHEMBL2115684 | 0.77 | ABL1 (0.62) | CAMK2DCDK2KDRABL1BCR | |
| SCHEMBL4660744 | 0.77 | CDK2 (0.48) | CAMK2DCDK2CDK1SMG1KDR | |
| SCHEMBL14380911 | 0.76 | IGF1R (0.74) | CAMK2DCDK2CDK1KDRABL1 | |
| SCHEMBL3952279 | 0.76 | DGAT1 (0.52) | CAMK2DGBA1MAOBGRM5CNR1 | |
| SCHEMBL12485602 | 0.75 | GBA1 (0.51) | CAMK2DCDK2CDK1SMG1ALK | |
| SCHEMBL6109641 | 0.75 | SMG1 (0.78) | CAMK2DCDK2CDK1SMG1ABL1 |
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-2009029617-A1 | DIARYLAMINE-SUBSTITUTED QUINOLONES USEFUL AS INDUCIBLE NITRIC OXIDE SYNTHASE INHIBITORS | KALYPSYS, INC. (US) | 2009-03-05 | — | — | WO | disclosed |