Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.57 |
| ▸ | GLA | P06280 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | CASP1 | P29466 | 1/20 | 0.57 |
| ▸ | CASP7 | P55210 | 1/20 | 0.57 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.57 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.57 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5555765 | 0.84 | ALDH1A1 (0.45) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL31509828 | 0.84 | ALDH1A1 (0.45) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL8933525 | 0.84 | KDM4E (0.58) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL15517761 | 0.84 | KDM4E (0.58) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL7058501 | 0.83 | KDM4E (0.57) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL8242672 | 0.81 | KDM4E (0.54) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL7618059 | 0.79 | ALDH1A1 (0.52) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL15521473 | 0.76 | CHRM4 (0.58) | KDM4EALDH1A1HPGDGAAHTT | |
| SCHEMBL27192197 | 0.75 | ALDH1A1 (0.51) | KDM4EALDH1A1GLAHPGDHSD17B10 | |
| SCHEMBL31509761 | 0.75 | ALDH1A1 (0.51) | KDM4EALDH1A1GLAHPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014035829-A1 | SUBSTITUTED 3-AMINOTHIENO[2,3-C]PYRIDINE-2-CARBOXAMIDE ANALOGS AS POSITIVE ALLOSTERIC MODULATORS | VANDERBILT UNIVERSITY (US) | 2014-03-06 | — | — | WO | disclosed |
| WO-2014035829-A1 | SUBSTITUTED 3-AMINOTHIENO[2,3-C]PYRIDINE-2-CARBOXAMIDE ANALOGS AS POSITIVE ALLOSTERIC MODULATORS | VANDERBILT UNIVERSITY (US) | 2014-03-06 | — | — | WO | disclosed |