Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 8/20 | 0.46 |
| ▸ | HTR2C | P28335 | 7/20 | 0.46 |
| ▸ | HTR2B | P41595 | 7/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL7841495 | 0.87 | HTR2A (0.62) | HTR2AHTR2CHTR2BEPHX2ALDH1A1 | |
| SCHEMBL7833793 | 0.82 | EPHX2 (0.46) | HTR2AEPHX2ALDH1A1MEN1USP2 | |
| Ammonia Solution, Strong SCHEMBL906070 | 0.79 | HTR2A (0.46) | HTR2AHTR2CHTR2BALDH1A1MEN1 | |
| SCHEMBL7674589 | 0.79 | HTR2A (0.58) | HTR2AHTR2CHTR2BEPHX2ALDH1A1 | |
| SCHEMBL7840357 | 0.76 | ALDH1A1 (0.42) | HTR2AHTR2CHTR2BEPHX2ALDH1A1 | |
| SCHEMBL7833297 | 0.75 | HTR2A (0.42) | HTR2AHTR2CHTR2BEPHX2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7845930 | 0.74 | HTR2A (0.57) | HTR2AHTR2CHTR2BEPHX2ALDH1A1 | |
| SCHEMBL6216648 | 0.74 | ALDH1A1 (0.72) | HTR2AEPHX2ALDH1A1MEN1USP2 | |
| SCHEMBL906067 | 0.73 | HTR2A (0.78) | HTR2AHTR2CHTR2BCYP1A2CYP3A4 | |
| SCHEMBL4572835 | 0.71 | CHRM2 (0.54) | HTR2AHTR2CHTR2BALDH1A1MEN1 |
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-1109784-A1 | INDOLINE DERIVATIVES AS 5-HT2B AND/OR 5-HT2C RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2001-06-27 | — | — | EP | claimed |
| WO-2000012475-A1 | INDOLINE DERIVATIVES AS 5-HT2B AND/OR 5-HT2C RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2000-03-09 | — | — | WO | claimed |