Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.45 |
| ▸ | HTR2C | P28335 | 5/20 | 0.45 |
| ▸ | HTR2B | P41595 | 4/20 | 0.45 |
| ▸ | KMO | O15229 | 9/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | QPCT | Q16769 | 1/20 | 0.34 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.33 |
| ▸ | SLC16A1 | P53985 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL6741175 | 0.98 | HTR2A (0.46) | HTR2AHTR2CHTR2BKMOHTR1A | |
| SCHEMBL3784975 | 0.80 | CHRM2 (0.41) | HTR2AHTR2CHTR2BKMOHTR1A | |
| Ammonia Solution, Strong SCHEMBL905935 | 0.79 | HTR2A (0.44) | HTR2AHTR2CHTR2BKMOHTR1A | |
| SCHEMBL8007547 | 0.79 | HTR2A (0.55) | HTR2AHTR2CHTR2BKMOHTR1A | |
| SCHEMBL31172027 | 0.79 | NOTUM (0.44) | HTR2AHTR2CHTR2BKMOCYP1A2 | |
| SCHEMBL2144057 | 0.79 | NOTUM (0.44) | HTR2AHTR2CHTR2BKMOCYP1A2 | |
| SCHEMBL3779615 | 0.79 | KMO (0.42) | HTR2AHTR2CHTR2BKMOHTR1A | |
| SCHEMBL20769975 | 0.79 | HTR2A (0.50) | HTR2AHTR2CHTR2BKMOHTR1A | |
| SCHEMBL14155061 | 0.79 | HTR2A (0.61) | HTR2AHTR2CHTR2BKMOHTR1A | |
| SCHEMBL8430529 | 0.79 | KMO (0.64) | HTR2AHTR2CHTR2BKMOHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000017170-A2 | N1-SUBSTITUTED BENZOPYRAZOLES AS INHIBITORS OF 5-HT2 RECEPTORS | VERNALIS RESEARCH LIMITED (GB) | 2000-03-30 | — | — | WO | disclosed |