Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | POLA1 | P09884 | 1/20 | 0.33 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | CCNH | P51946 | 1/20 | 0.32 |
| ▸ | TYMP | P19971 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3044447 | 0.88 | ALDH1A1 (0.41) | ALDH1A1KDM4ERXFP1HPRT1CDK2 | |
| SCHEMBL8708640 | 0.84 | ALDH1A1 (0.38) | ALDH1A1KDM4ERXFP1HPRT1CDK2 | |
| SCHEMBL9617743 | 0.81 | ALDH1A1 (0.40) | ALDH1A1KDM4ERXFP1HPRT1CDK2 | |
| SCHEMBL3054565 | 0.80 | HPRT1 (0.38) | HPRT1FGFR1SLC22A6TYMP | |
| SCHEMBL5482507 | 0.78 | ALDH1A1 (0.47) | ALDH1A1KDM4ERXFP1CDK2POLA1 | |
| SCHEMBL3837871 | 0.78 | PDPK1 (0.43) | HPRT1CDK2FGFR1SLC22A6POLA1 | |
| SCHEMBL460357 | 0.77 | ALDH1A1 (0.36) | ALDH1A1KDM4ERXFP1CDK2 | |
| SCHEMBL27658630 | 0.75 | ALDH1A1 (0.50) | ALDH1A1KDM4ERXFP1CDK2POLA1 | |
| SCHEMBL21274620 | 0.71 | ALDH1A1 (0.44) | ALDH1A1KDM4ERXFP1CDK2POLA1 | |
| SCHEMBL11077322 | 0.71 | ALDH1A1 (0.50) | ALDH1A1KDM4ERXFP1CDK2POLA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7790905-B2 | Pharmaceutical propylene glycol solvate compositions | MCNEIL-PPC, INC. (US) | 2010-09-07 | — | — | US | disclosed |