Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 4/20 | 0.42 |
| ▸ | BCHE | P06276 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL8504696 | 0.84 | PKM (0.36) | HPGDCYP1A2CYP2C19TSHRALDH1A1 | |
| SCHEMBL8505814 | 0.84 | ADRB2 (0.42) | HPGDCYP1A2CYP2C19CYP2D6TSHR | |
| SCHEMBL8504905 | 0.83 | ALDH1A1 (0.40) | HPGDCYP1A2CYP2C19CYP2D6TSHR | |
| SCHEMBL8502095 | 0.80 | ROCK2 (0.39) | CYP1A2CYP2C19ALDH1A1GAAMAPT | |
| SCHEMBL7590521 | 0.77 | HPGD (0.48) | HPGDCYP1A2CYP2C19CYP2D6TACR1 | |
| SCHEMBL8526363 | 0.76 | MAPT (0.44) | ALDH1A1HTTMAPTLMNA | |
| SCHEMBL9364036 | 0.73 | CYP1A2 (0.66) | HPGDCYP1A2CYP2C19CYP2D6TACR1 | |
| SCHEMBL10703272 | 0.73 | CYP1A2 (0.61) | HPGDCYP1A2CYP2C19CYP2D6TACR1 | |
| SCHEMBL5110570 | 0.73 | CYP1A2 (0.61) | HPGDCYP1A2CYP2C19CYP2D6TACR1 | |
| SCHEMBL8505747 | 0.72 | KMT2A (0.45) | CYP2C19TSHRALDH1A1GAAHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5886178-A | ADMINISTERING OF A PROSTAGLANDIN G/H SYNTHASE INHIBITOR TO A PATIENT TO TREAT INFLAMMATORY OR AUTOIMMUNE DISEASES | SYNTEX (U.S.A.) INC. (US) | 1999-03-23 | — | — | US | disclosed |