Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9824284 | 0.92 | S1PR1 (0.40) | S1PR1S1PR3S1PR5KMT2APOLB | |
| SCHEMBL9824846 | 0.85 | CYP1A2 (0.42) | KMT2AMEN1CYP1A2CYP3A4CHRM2 | |
| SCHEMBL9824618 | 0.83 | ALDH1A1 (0.41) | S1PR1S1PR3S1PR5KMT2APOLB | |
| SCHEMBL9245124 | 0.82 | ALDH1A1 (0.38) | S1PR1S1PR3S1PR5KMT2APOLB | |
| SCHEMBL28296702 | 0.81 | ALDH1A1 (0.37) | S1PR1S1PR3S1PR5KMT2APOLB | |
| SCHEMBL5014206 | 0.80 | KMT2A (0.48) | KMT2ATSHRMEN1ALDH1A1ALOX15 | |
| SCHEMBL11020011 | 0.79 | CHRM2 (0.38) | KMT2APOLBTSHRCHRM2CHRM4 | |
| SCHEMBL16508870 | 0.79 | S1PR1 (0.42) | S1PR1S1PR3S1PR5POLBALDH1A1 | |
| SCHEMBL9824423 | 0.78 | S1PR1 (0.38) | S1PR1S1PR3S1PR5CYP1A2OPRD1 | |
| SCHEMBL27799980 | 0.76 | ALDH1A1 (0.41) | S1PR1S1PR3S1PR5KMT2ATSHR |
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-0273239-B1 | CONDENSED DIAZEPINONES, PROCESSES FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1991-03-06 | — | — | EP | disclosed |
| US-4873236-A | BRADYCARDIAL AGENTS | DR. KARL THOMAE GMBH (DE) | 1989-10-10 | — | — | US | disclosed |
| EP-0273239-A1 | Condensed diazepinones, processes for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1988-07-06 | — | — | EP | disclosed |