Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 7/20 | 0.56 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7909538 | 0.89 | ABCB1 (0.60) | ABCB1CALM1ALDH1A1LMNATP53 | |
| SCHEMBL7909614 | 0.88 | ABCB1 (0.53) | ABCB1CALM1CYP3A4MAPTMAPK1 | |
| SCHEMBL7098373 | 0.85 | KDM4E (0.58) | ABCB1KDM4EALDH1A1LMNATP53 | |
| SCHEMBL7917258 | 0.84 | ABCB1 (0.58) | ABCB1CALM1ENPP2HTR1ADRD2 | |
| SCHEMBL8723189 | 0.81 | ABCB1 (0.52) | ABCB1CALM1KDM4EALDH1A1LMNA | |
| SCHEMBL7510928 | 0.80 | MAPT (0.46) | KDM4EALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL8896923 | 0.80 | ABCB1 (0.51) | ABCB1CALM1KDM4EALDH1A1LMNA | |
| SCHEMBL8723684 | 0.79 | ABCB1 (0.53) | ABCB1CALM1TP53PTPN1ENPP2 | |
| SCHEMBL8721199 | 0.78 | ABCB1 (0.49) | ABCB1CALM1ALDH1A1TP53PTPN1 | |
| SCHEMBL7917111 | 0.77 | MAOB (0.62) | ABCB1MAOBGABRA1GABRG2GABRB3 |
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-6225352-B1 | USEFUL AS AGENTS IN THE TREATMENT OF CANCER, ALZHEIMERS DISEASE, THROMBOSIS, INFLAMMATORY DISEASES, AND BACTERIAL RESISTANCE | WARNER-LAMBERT COMPANY | 2001-05-01 | — | — | US | disclosed |
| WO-1998006691-A2 | LOW MOLECULAR WEIGHT DENDRITIC COMPOUNDS AS PHARMACEUTICAL AGENTS | WARNER-LAMBERT COMPANY (US) | 1998-02-19 | — | — | WO | disclosed |