Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL11205372 | 0.88 | TP53 (0.36) | KMT2AMEN1PTGS1MAPTMAPK1 | |
| SCHEMBL11201233 | 0.82 | ELANE (0.39) | KMT2AMEN1MAPTMAPK1CYP1A2 | |
| SCHEMBL11413848 | 0.78 | — | — | |
| SCHEMBL11200277 | 0.78 | MEN1 (0.33) | KMT2AMEN1MAPTNPC1RAB9A | |
| SCHEMBL11211362 | 0.77 | ALDH1A1 (0.44) | KMT2AMAPTCYP1A2CYP3A4TP53 | |
| SCHEMBL11404541 | 0.76 | EPHX1 (0.40) | KMT2AMEN1ADORA3THRBCHRM1 | |
| SCHEMBL11402204 | 0.76 | KMT2A (0.34) | KMT2AMEN1ADORA3THRBCHRM1 | |
| SCHEMBL11204824 | 0.71 | ALDH1A1 (0.36) | KMT2AMEN1ADORA3THRBCHRM1 | |
| SCHEMBL13940537 | 0.68 | MEN1 (0.41) | KMT2AMEN1THRBMAPTMAPK1 | |
| SCHEMBL13302892 | 0.65 | ACHE (0.39) | KMT2AMEN1THRBMAPTMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0091041-A2 | Vinylogous carboxamides, process for preparing them and medicines containing these compounds | Dr. Karl Thomae GmbH (DE) | 1983-10-12 | — | — | EP | disclosed |
| EP-0025489-A1 | Vinylogous carboxamides, medicaments containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1981-03-25 | — | — | EP | disclosed |