Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GNRHR | P30968 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.34 |
| ▸ | F2R | P25116 | 2/20 | 0.34 |
| ▸ | OGA | O60502 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624254 | 0.84 | GNRHR (0.46) | KDM4EGNRHRALDH1A1GAA | |
| SCHEMBL9623765 | 0.79 | GNRHR (0.38) | KDM4EGNRHRTGFBR1MAPTBCHE | |
| SCHEMBL9624316 | 0.78 | GNRHR (0.45) | KDM4EGNRHRSIGMAR1 | |
| SCHEMBL9624080 | 0.77 | SMN1; SMN2 (0.39) | KDM4ESIGMAR1NPC1RAB9AALDH1A1 | |
| SCHEMBL9624258 | 0.75 | SMN1; SMN2 (0.42) | KDM4ESIGMAR1NPC1RAB9AALDH1A1 | |
| SCHEMBL9623557 | 0.74 | SIGMAR1 (0.40) | SIGMAR1RAB9ABCHE | |
| SCHEMBL9204444 | 0.74 | KDM4E (0.43) | KDM4ETGFBR1OGANPC1RAB9A | |
| SCHEMBL9624495 | 0.73 | SIGMAR1 (0.38) | KDM4ESIGMAR1MAPTALDH1A1 | |
| SCHEMBL9625255 | 0.71 | SIGMAR1 (0.45) | KDM4ESIGMAR1MAPTALDH1A1GAA | |
| SCHEMBL9624933 | 0.70 | HDAC6 (0.38) | KDM4EGNRHRMAPTALDH1A1 |
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 |