Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | PDE2A | O00408 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | EED | O75530 | 1/20 | 0.31 |
| ▸ | SUZ12 | Q15022 | 1/20 | 0.31 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23912908 | 0.88 | NPC1 (0.34) | RXFP1THRBNPC1ALDH1A1PDE2A | |
| SCHEMBL20156083 | 0.85 | ITGB3 (0.40) | ALDH1A1PDE2AMEN1KMT2A | |
| SCHEMBL20156278 | 0.83 | WDR5 (0.32) | — | |
| SCHEMBL21281650 | 0.77 | ALDH1A1 (0.39) | RXFP1THRBNPC1ALDH1A1PDE2A | |
| SCHEMBL20156349 | 0.76 | ITGB3 (0.49) | — | |
| SCHEMBL20156365 | 0.74 | MAPT (0.39) | ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2 | |
| SCHEMBL30594182 | 0.72 | NPC1 (0.40) | RXFP1THRBNPC1ALDH1A1PDE2A | |
| SCHEMBL20156279 | 0.70 | SUCNR1 (0.37) | — | |
| SCHEMBL20156361 | 0.70 | NQO2 (0.30) | ALDH1A1 | |
| SCHEMBL20156077 | 0.70 | NPC1 (0.40) | RXFP1THRBNPC1ALDH1A1PDE2A |
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 |