Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | PRKCG | P05129 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.43 |
| ▸ | AKT2 | P31751 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11617923 | 0.98 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL1579372 | 0.89 | ALDH1A1 (0.54) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL19430793 | 0.86 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL19473011 | 0.86 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL15924404 | 0.84 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL3747473 | 0.84 | HPGD (0.50) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL17654321 | 0.84 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL7996217 | 0.84 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL1964745 | 0.83 | MRGPRX4 (0.49) | ALDH1A1HPGDKDM4EHTTL3MBTL1 | |
| SCHEMBL28328487 | 0.83 | ALDH1A1 (0.58) | ALDH1A1HPGDKDM4EHTTL3MBTL1 |
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-4108894-A | Amidines | E. R. SQUIBB & SONS, INC. (US) | 1978-08-22 | — | — | US | disclosed |
| US-4086244-A | ANTIINFLAMMATORY AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1978-04-25 | — | — | US | disclosed |