Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10653342 | 0.84 | ATM (0.51) | KDM4EHPGDNPSR1ADORA2BADORA1 | |
| SCHEMBL10656112 | 0.83 | ALDH1A1 (0.50) | KDM4EHPGDNPSR1ADORA1KMT2A | |
| SCHEMBL10653380 | 0.80 | GRIA2 (0.33) | KDM4EHPGDNPSR1KMT2AALDH1A1 | |
| SCHEMBL10653117 | 0.77 | ABL1 (0.40) | ADORA1ADORA2AIDO1PTGS2PRKCZ | |
| SCHEMBL10651486 | 0.75 | PTGS2 (0.43) | KDM4EHPGDNPSR1RXFP1KMT2A | |
| SCHEMBL10652386 | 0.75 | GRIA2 (0.42) | SLC22A12KMT2AALDH1A1SMN1; SMN2PTGS2 | |
| SCHEMBL10656208 | 0.73 | NPSR1 (0.50) | KDM4EHPGDNPSR1RXFP1ADORA1 | |
| SCHEMBL10651545 | 0.71 | HSP90AA1 (0.40) | KDM4EHPGDNPSR1RXFP1ADORA1 | |
| SCHEMBL10651866 | 0.69 | KDM4E (0.47) | KDM4EHPGDNPSR1KDRKMT2A | |
| SCHEMBL24910100 | 0.68 | ACLY (0.44) | KDM4EHPGDNPSR1RXFP1SLC22A12 |
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-0273602-A1 | 3-Cyano-4-arylthiophenes | ELI LILLY AND COMPANY (US) | 1988-07-06 | — | — | EP | disclosed |