Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7415646 | 1.00 | KMT2A (0.48) | KMT2AMEN1HTTMAPK1ALDH1A1 | |
| SCHEMBL3537949 | 0.86 | ALDH1A1 (0.51) | KMT2AMEN1ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL26398493 | 0.86 | ALDH1A1 (0.51) | KMT2AMEN1ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL10132243 | 0.83 | NPC1 (0.58) | KMT2AMEN1ALDH1A1L3MBTL1NPSR1 | |
| SCHEMBL19817229 | 0.79 | KDM4E (0.54) | KMT2AMEN1ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL9873582 | 0.79 | ALDH1A1 (0.55) | KMT2AMEN1ALDH1A1L3MBTL1HSD11B1 | |
| SCHEMBL11112030 | 0.78 | HSD11B1 (0.47) | KMT2AHTTALDH1A1HSD11B1THRB | |
| SCHEMBL9872456 | 0.77 | HSD11B1 (0.60) | KMT2AMEN1HTTALDH1A1TDP1 | |
| SCHEMBL20482498 | 0.76 | L3MBTL1 (0.53) | ALDH1A1TSHRL3MBTL1NPSR1 | |
| SCHEMBL10600330 | 0.76 | HSD11B1 (0.65) | HTTALDH1A1TDP1HSD11B1CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5198449-A | N-substituted alpha-arylazacycloalkylmethanamines and their use as cardiovascular agents | A. H. ROBINS COMPANY INCORPORATED (US) | 1993-03-30 | — | — | US | disclosed |