Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARD | Q03181 | 2/20 | 0.48 |
| ▸ | PPARA | Q07869 | 2/20 | 0.48 |
| ▸ | TACR1 | P25103 | 10/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | RXRG | P48443 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10077533 | 0.84 | PPARA (0.56) | PPARDPPARAEPHX2PPARG | |
| SCHEMBL14947065 | 0.84 | PPARA (0.56) | PPARDPPARAEPHX2PPARG | |
| SCHEMBL7612638 | 0.83 | HTR2A (0.66) | PPARDPPARAPPARGHTR2AHTR2C | |
| SCHEMBL14427296 | 0.83 | PPARD (0.44) | PPARDPPARATACR1ALDH1A1CES2 | |
| SCHEMBL2165859 | 0.81 | KDM6B (0.47) | PPARATACR1CES2RXRARXRB | |
| SCHEMBL2165857 | 0.81 | KDM6B (0.47) | PPARATACR1CES2RXRARXRB | |
| SCHEMBL1311116 | 0.80 | GRB2 (0.57) | TACR1ALDH1A1HTR2A | |
| SCHEMBL1311115 | 0.80 | GRB2 (0.57) | TACR1ALDH1A1HTR2A | |
| SCHEMBL25356612 | 0.80 | ACE (0.46) | TACR1ALDH1A1 | |
| SCHEMBL25356607 | 0.80 | ACE (0.46) | TACR1ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110283066-A | It is a kind of how smooth intermediate 2-(3,5- bis- (trifluoromethyl) phenyl of appropriate pyrrole) -2 Methylpropionic acid synthetic method | 青岛君之道生物技术有限公司 | 2019-09-27 | — | — | CN | claimed |
| CN-105541594-A | Synthetic method for netupitant intermediate 2-(3,5-bistrifluoromethylphenyl)-2-methyl propionate | HEFEI LIFU BIOTECHNOLOGY CO LTD | 2016-05-04 | — | — | CN | claimed |
| CN-110283066-A | It is a kind of how smooth intermediate 2-(3,5- bis- (trifluoromethyl) phenyl of appropriate pyrrole) -2 Methylpropionic acid synthetic method | 青岛君之道生物技术有限公司 | 2019-09-27 | — | — | CN | disclosed |
| CN-105541594-A | Synthetic method for netupitant intermediate 2-(3,5-bistrifluoromethylphenyl)-2-methyl propionate | HEFEI LIFU BIOTECHNOLOGY CO LTD | 2016-05-04 | — | — | CN | disclosed |
| CN-105541593-A | Method for synthesizing drug intermediate | HEFEI LIFU BIOTECHNOLOGY CO LTD | 2016-05-04 | — | — | CN | disclosed |