Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.35 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.34 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4719067 | 0.87 | ITGB2 (0.35) | HTR2AHTR2CHTR2BF2F10 | |
| SCHEMBL4719061 | 0.87 | ITGB2 (0.35) | HTR2AHTR2CHTR2BF2F10 | |
| SCHEMBL14101744 | 0.84 | AKR1B10 (0.35) | F2F10ACVR1TGFBR1MAP4K1 | |
| SCHEMBL14102034 | 0.83 | KDM4E (0.37) | F2F10ACVR1MAP4K1HSD17B10 | |
| SCHEMBL14102029 | 0.83 | ACHE (0.40) | F2F10ACVR1HSD17B10KDM4E | |
| SCHEMBL14101836 | 0.77 | SMN1; SMN2 (0.39) | F2F10HSD17B10KDM4EALOX15 | |
| SCHEMBL14101967 | 0.77 | MEN1 (0.36) | AKR1B10AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL14101726 | 0.75 | F2 (0.37) | F2F10ACVR1AKR1B10AKR1C4 | |
| SCHEMBL14101837 | 0.75 | F10 (0.40) | HTR2AHTR2CHTR2BF2F10 | |
| SCHEMBL14102089 | 0.74 | MAPT (0.36) | F2F10ACVR1AKR1B10AKR1C4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |