Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 2/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 4/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | RXRA | P19793 | 2/20 | 0.43 |
| ▸ | RXRB | P28702 | 2/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | VCP | P55072 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2540994 | 0.99 | SERPINE1 (0.48) | SERPINE1EPHX2NR1H4PPARDTRPV1 | |
| SCHEMBL2540995 | 0.93 | EPHX2 (0.46) | SERPINE1EPHX2NR1H4PPARDTRPV1 | |
| SCHEMBL2533885 | 0.92 | EPHX2 (0.47) | SERPINE1EPHX2NR1H4PPARDTRPV1 | |
| SCHEMBL2540485 | 0.91 | EPHX2 (0.46) | SERPINE1EPHX2NR1H4PPARDTRPV1 | |
| SCHEMBL13581072 | 0.82 | EPHX2 (0.50) | SERPINE1EPHX2NR1H4PPARDTRPV1 | |
| SCHEMBL2534864 | 0.81 | SERPINE1 (0.52) | SERPINE1EPHX2NR1H4PPARDTRPV1 | |
| SCHEMBL1242210 | 0.81 | EPHX2 (0.45) | SERPINE1EPHX2NR1H4PPARDPPARA | |
| SCHEMBL2539640 | 0.81 | PPARD (0.50) | SERPINE1EPHX2NR1H4PPARDRXRA | |
| SCHEMBL13580799 | 0.80 | EPHX2 (0.46) | SERPINE1EPHX2NR1H4PPARDTRPV1 | |
| SCHEMBL2537365 | 0.80 | SERPINE1 (0.48) | SERPINE1EPHX2NR1H4PPARDRXRA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2080751-A1 | CARBOXYLIC ACID DERIVATIVE | Institute of Medicinal Molecular Design, Inc. (JP) | 2009-07-22 | — | — | EP | disclosed |