Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 6/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.36 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.36 |
| ▸ | GRK6 | P43250 | 1/20 | 0.35 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.34 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL15529588 | 0.72 | MAPT (0.49) | CYP1A2CYP2C9RAB9ANPC1MAP2K4 | |
| SCHEMBL15529377 | 0.71 | MEN1 (0.57) | RAB9ANPC1MAPTKMT2A | |
| SCHEMBL6268106 | 0.69 | CYP1A2 (0.56) | CYP1A2CYP2C9RAB9ANPC1NR1I3 | |
| SCHEMBL6268102 | 0.68 | CYP1A2 (0.55) | CYP1A2CYP2C9RAB9ANPC1NR1I3 | |
| SCHEMBL15528643 | 0.65 | F2 (0.61) | CYP1A2CYP2C9TP53MAPTKMT2A | |
| SCHEMBL12978 | 0.63 | CYP1A2 (0.67) | CYP1A2CYP2C9RAB9ANPC1ATR | |
| SCHEMBL10891948 | 0.63 | NR1H2 (0.71) | CYP1A2CYP2C9RAB9ANPC1GRK6 | |
| SCHEMBL24660583 | 0.62 | CYP1A2 (0.54) | CYP1A2CYP2C9RAB9ANPC1GRK6 | |
| SCHEMBL14778494 | 0.62 | CYP1A2 (0.53) | CYP1A2CYP2C9RAB9ANPC1MAPT | |
| SCHEMBL5182551 | 0.61 | ALDH1A1 (0.47) | CYP1A2CYP2C9ALOX5PPARGKMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2850068-A1 | GPR17 RECEPTOR MODULATORS. | Universita' degli Studi di Milano (IT) | 2015-03-25 | — | — | EP | claimed |
| WO-2013167177-A1 | GPR17 RECEPTOR MODULATORS. | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2013-11-14 | — | — | WO | claimed |
| EP-2850068-A1 | GPR17 RECEPTOR MODULATORS. | Universita' degli Studi di Milano (IT) | 2015-03-25 | — | — | EP | disclosed |
| WO-2013167177-A1 | GPR17 RECEPTOR MODULATORS. | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2013-11-14 | — | — | WO | disclosed |