Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 8/20 | 0.44 |
| ▸ | CDK4 | P11802 | 7/20 | 0.44 |
| ▸ | CDK1 | P06493 | 7/20 | 0.44 |
| ▸ | CCND1 | P24385 | 6/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 6/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.44 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.44 |
| ▸ | CDK9 | P50750 | 7/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 6/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.42 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.42 |
| ▸ | CASK | O14936 | 1/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.42 |
| ▸ | CDK7 | P50613 | 1/20 | 0.42 |
| ▸ | CCNH | P51946 | 1/20 | 0.42 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.42 |
| ▸ | MAPK15 | Q8TD08 | 1/20 | 0.42 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.42 |
| ▸ | CCND3 | P30281 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8821026 | 0.88 | CDK4 (0.60) | CDK2CDK4CDK1CCND1CCNB1 | |
| SCHEMBL8821077 | 0.85 | CDK2 (0.34) | CDK2CDK4CDK1CCND1CCNB1 | |
| SCHEMBL16180379 | 0.81 | CCNT1 (0.58) | CDK2CDK4CDK1CCND1CCNE1 | |
| SCHEMBL16180166 | 0.80 | CDK9 (0.53) | CDK2CDK4CDK1CCND1CCNB1 | |
| SCHEMBL7829623 | 0.79 | CDK4 (0.64) | CDK2CDK4CDK1CCND1CCNB1 | |
| SCHEMBL4585801 | 0.79 | CDK4 (0.64) | CDK2CDK4CDK1CCND1CCNB1 | |
| Hydrochloric Acid SCHEMBL4447778 | 0.78 | CDK4 (0.65) | CDK2CDK4CDK1CCND1CCNB1 | |
| Hydrochloric Acid SCHEMBL15636652 | 0.78 | CDK4 (0.65) | CDK2CDK4CDK1CCND1CCNB1 | |
| SCHEMBL23414457 | 0.77 | CDK9 (0.35) | CDK2CDK4CDK1CCND1CCNB1 | |
| SCHEMBL16179650 | 0.76 | CCNT1 (0.60) | CDK2CDK4CDK1CCND1CCNE1 |
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-1997042949-A1 | 2-THIO OR 2-OXO FLAVOPIRIDOL ANALOGS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1997-11-20 | — | — | WO | disclosed |