Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SUCNR1 | Q9BXA5 | 11/20 | 0.43 |
| ▸ | OXGR1 | Q96P68 | 1/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6899530 | 0.89 | SUCNR1 (0.47) | HRH1PDE10AALDH1A1SUCNR1OXGR1 | |
| SCHEMBL19952703 | 0.85 | ALDH1A1 (0.47) | HRH1PDE10AALDH1A1KDM4ELMNA | |
| SCHEMBL12895009 | 0.83 | PDE10A (0.49) | PDE10AALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL23083184 | 0.81 | PDE10A (0.49) | PDE10AALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL28337161 | 0.81 | PDE10A (0.48) | PDE10AALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL27705784 | 0.81 | PDE10A (0.48) | PDE10AALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL21281605 | 0.81 | PDE10A (0.45) | PDE10AALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL30930276 | 0.80 | SUCNR1 (0.50) | PDE10ASUCNR1OXGR1 | |
| SCHEMBL276117 | 0.79 | SUCNR1 (0.50) | PDE10AALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL6129289 | 0.79 | KCNH2 (0.55) | PDE10AALDH1A1SUCNR1OXGR1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3538527-B1 | AZOLE AMIDES AND AMINES AS ALPHA V INTEGRIN INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2021-10-13 | — | — | EP | disclosed |
| WO-2018089358-A1 | AZOLE AMIDES AND AMINES AS ALPHA V INTEGRIN INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-17 | — | — | WO | disclosed |