Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | LTA4H | P09960 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624309 | 0.99 | NAAA (0.35) | MAPTHCN4ALOX15CYP3A4NAAA | |
| SCHEMBL9625302 | 0.97 | MAPT (0.36) | MAPTHCN4ALOX15CYP3A4NAAA | |
| SCHEMBL9624078 | 0.95 | MAPT (0.39) | MAPTHCN4ALOX15CYP3A4KDM4E | |
| SCHEMBL10400894 | 0.83 | CNR2 (0.46) | MAPTHCN4ALOX15CYP3A4KDM4E | |
| SCHEMBL9624517 | 0.83 | LMNA (0.35) | MAPTHCN4ALOX15CYP3A4KDM4E | |
| SCHEMBL10645569 | 0.83 | CNR2 (0.45) | MAPTHCN4ALOX15CYP3A4KDM4E | |
| SCHEMBL10401291 | 0.82 | NAAA (0.36) | MAPTHCN4ALOX15CYP3A4NAAA | |
| SCHEMBL9624304 | 0.82 | LMNA (0.35) | MAPTHCN4ALOX15CYP3A4KDM4E | |
| SCHEMBL9624853 | 0.80 | CNR2 (0.47) | MAPTHCN4ALOX15CYP3A4KDM4E | |
| SCHEMBL9625024 | 0.80 | MAPT (0.36) | MAPTHCN4ALOX15CYP3A4KDM4E |
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-5116986-A | HETEROAROMATIC AMINE DERIVATIVES | DR. KARL THOMAE GMBH (DE) | 1992-05-26 | — | — | US | disclosed |
| US-4912115-A | Cardiovascular disorders | DR. KARL THOMAE GMBH (DE) | 1990-03-27 | — | — | US | disclosed |
| EP-0269968-A2 | Heteroaromatic amine derivatives, medicaments containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-06-08 | — | — | EP | disclosed |