Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 3/20 | 0.48 |
| ▸ | MMP9 | P14780 | 3/20 | 0.48 |
| ▸ | MMP12 | P39900 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.40 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11430842 | 0.87 | MMP2 (0.63) | AKR1B1MMP2MMP9MMP12GAA | |
| SCHEMBL11551886 | 0.82 | AKR1B1 (0.62) | AKR1B1MMP2MMP9MMP12GAA | |
| SCHEMBL30733478 | 0.82 | AKR1B1 (0.62) | AKR1B1MMP2MMP9MMP12GAA | |
| SCHEMBL11427396 | 0.80 | AKR1B1 (0.56) | AKR1B1MMP2MMP9MMP12GAA | |
| SCHEMBL11552428 | 0.77 | AKR1B1 (0.51) | AKR1B1MMP2MMP9MMP12GAA | |
| SCHEMBL11400370 | 0.75 | AKR1B1 (0.46) | AKR1B1MMP2MMP9MMP12GAA | |
| SCHEMBL11554666 | 0.74 | MMP2 (0.49) | MMP2MMP9MMP12GAALMNA | |
| SCHEMBL11442734 | 0.73 | AKR1B1 (0.53) | AKR1B1GAALMNAPOLBHPGD | |
| SCHEMBL11351435 | 0.72 | AGBL2 (0.53) | MMP2MMP9MMP12LMNAHPGD | |
| SCHEMBL109215 | 0.69 | AKR1B1 (1.00) | AKR1B1GAALMNACYP2C9CYP2C19 |
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-4166127-A | ANTIINFLAMMATORY AGENTS | NIPPON CHEMIPHAR CO., LTD. (JP) | 1979-08-28 | — | — | US | disclosed |
| US-4101667-A | ANTIINFLAMMATORY AGENTS | NIPPON CHEMIPHAR CO., LTD. (JP) | 1978-07-18 | — | — | US | disclosed |