Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | HTR3A | P46098 | 7/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7301108 | 0.95 | KDM4E (0.56) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| SCHEMBL12486470 | 0.84 | KDM4E (0.69) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| SCHEMBL3724624 | 0.81 | HTR3A (0.56) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| SCHEMBL3724622 | 0.81 | HTR3A (0.56) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| SCHEMBL7490360 | 0.81 | HTR3A (0.56) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| SCHEMBL2318444 | 0.81 | HTR3A (0.56) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| SCHEMBL7302304 | 0.81 | KDM4E (0.61) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL467193 | 0.80 | HTR3A (0.55) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| Iodomethane SCHEMBL1309118 | 0.79 | HTR3A (0.54) | KDM4EHTR3AMEN1KMT2AALDH1A1 | |
| SCHEMBL7297920 | 0.78 | KDM4E (0.52) | KDM4EHTR3AMEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5252570-A | Amidino and guanidino derivatives | B.I. ITALIA (IT) | 1993-10-12 | — | — | US | disclosed |
| US-5047410-A | Indolyl derivatives and their use as 5-HT3, receptor antagonists | ISTITUTO DE ANGELI S.P.A. (IT) | 1991-09-10 | — | — | US | disclosed |
| EP-0351385-A2 | New amidino and guanidino derivatives | BOEHRINGER INGELHEIM ITALIA S.p.A. (IT) | 1990-01-17 | — | — | EP | disclosed |