Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | VCP | P55072 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7572281 | 1.00 | MEN1 (0.51) | MEN1KMT2ACYP19A1CA1CA2 | |
| SCHEMBL7571237 | 0.92 | MEN1 (0.58) | MEN1KMT2ACA1CA2AMY1A | |
| SCHEMBL7571243 | 0.92 | MEN1 (0.58) | MEN1KMT2ACA1CA2AMY1A | |
| SCHEMBL7579658 | 0.91 | NFE2L2 (0.53) | MEN1KMT2ACA1CA2AMY1A | |
| SCHEMBL7575174 | 0.89 | ALDH1A1 (0.42) | MEN1KMT2ACYP19A1CA1CA2 | |
| SCHEMBL7575172 | 0.89 | ALDH1A1 (0.42) | MEN1KMT2ACYP19A1CA1CA2 | |
| SCHEMBL7573475 | 0.88 | NFE2L2 (0.56) | MEN1KMT2ACA1CA2AMY1A | |
| SCHEMBL7581527 | 0.88 | MEN1 (0.49) | MEN1KMT2AALDH1A1PTGS2NPC1 | |
| SCHEMBL7581536 | 0.88 | MEN1 (0.49) | MEN1KMT2AALDH1A1PTGS2NPC1 | |
| SCHEMBL7572739 | 0.87 | MEN1 (0.49) | MEN1KMT2ACA1CA2AMY1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0810199-B1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL CO (JP) | 2002-09-25 | — | — | EP | disclosed |
| US-5756769-A | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0810199-A1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-12-03 | — | — | EP | disclosed |