Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9824013 | 0.83 | ADRB2 (0.46) | MEN1NPC1HPGDMAPK1KMT2A | |
| SCHEMBL9823697 | 0.80 | ADRB2 (0.48) | MAPTSMN1; SMN2ADRB2ADRB1ADRB3 | |
| SCHEMBL9824793 | 0.75 | IDO1 (0.51) | IDO1MAPTKMT2ACA1CA2 | |
| SCHEMBL9823868 | 0.69 | IDO1 (0.45) | IDO1MAPTKMT2ACA1CA2 | |
| SCHEMBL2468850 | 0.68 | MAPT (0.56) | MAPTMEN1LMNATP53MAPK1 | |
| SCHEMBL11465475 | 0.67 | NOTUM (0.46) | IDO1MAPTTP53MAPK1ESR1 | |
| SCHEMBL11456151 | 0.67 | CYP19A1 (0.43) | IDO1MAPTMEN1USP2LMNA | |
| SCHEMBL27857452 | 0.65 | CYP3A4 (0.45) | IDO1MAPTMEN1USP2LMNA | |
| SCHEMBL10824816 | 0.65 | THRB (0.40) | IDO1MAPTHPGDNPSR1ADRB2 | |
| SCHEMBL10824819 | 0.65 | THRB (0.40) | IDO1MAPTHPGDNPSR1ADRB2 |
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-0227100-B1 | N-VINYLIMIDAZOLES AND -TRIAZOLES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1991-04-03 | — | — | EP | claimed |
| EP-0227100-B1 | N-VINYLIMIDAZOLES AND -TRIAZOLES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1991-04-03 | — | — | EP | disclosed |