Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 | Q9BQB6 | 2/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | NDUFS8 | O00217 | 1/20 | 0.51 |
| ▸ | COXFA4 | O00483 | 1/20 | 0.51 |
| ▸ | NDUFAB1 | O14561 | 1/20 | 0.51 |
| ▸ | NDUFA1 | O15239 | 1/20 | 0.51 |
| ▸ | NDUFS4 | O43181 | 1/20 | 0.51 |
| ▸ | NDUFB5 | O43674 | 1/20 | 0.51 |
| ▸ | NDUFB3 | O43676 | 1/20 | 0.51 |
| ▸ | NDUFC1 | O43677 | 1/20 | 0.51 |
| ▸ | NDUFA2 | O43678 | 1/20 | 0.51 |
| ▸ | NDUFS5 | O43920 | 1/20 | 0.51 |
| ▸ | NDUFS7 | O75251 | 1/20 | 0.51 |
| ▸ | NDUFS2 | O75306 | 1/20 | 0.51 |
| ▸ | NDUFS6 | O75380 | 1/20 | 0.51 |
| ▸ | NDUFB1 | O75438 | 1/20 | 0.51 |
| ▸ | NDUFS3 | O75489 | 1/20 | 0.51 |
| ▸ | NDUFB6 | O95139 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL27599592 | 0.90 | VKORC1 (0.62) | VKORC1ALOX15TDP1KDM4ENDUFS8 | |
| SCHEMBL27442812 | 0.89 | VKORC1 (0.67) | VKORC1NQO1MAOBMAOAMGAM | |
| SCHEMBL27582360 | 0.89 | VKORC1 (0.61) | VKORC1ALOX15TDP1KDM4ENDUFS8 | |
| SCHEMBL8488498 | 0.87 | ALOX15 (0.58) | VKORC1ALOX15TDP1KDM4ENDUFS8 | |
| SCHEMBL8488507 | 0.87 | ALOX15 (0.58) | VKORC1ALOX15TDP1KDM4ENDUFS8 | |
| SCHEMBL29517210 | 0.85 | VKORC1 (0.74) | VKORC1NQO1MGAMGAASI | |
| SCHEMBL8494423 | 0.83 | ALOX15 (0.64) | VKORC1ALOX15TDP1KDM4ENDUFS8 | |
| SCHEMBL27599715 | 0.81 | VKORC1 (0.62) | VKORC1ALOX15TDP1KDM4ENDUFS8 | |
| SCHEMBL8490417 | 0.81 | ALOX15 (0.62) | VKORC1ALOX15TDP1KDM4ENDUFS8 | |
| SCHEMBL5309688 | 0.81 | VKORC1 (1.00) | VKORC1ALOX15ALDH1A1CYP3A4MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1101678-C | Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient | DAINIPPON INK & CHEMICALS (JP) | 2003-02-19 | — | — | CN | disclosed |
| CN-1164999-A | Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient | DAINIPPON INK & CHEMICALS (JP) | 1997-11-19 | — | — | CN | disclosed |