Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH5 | P11766 | 1/20 | 0.41 |
| ▸ | GP6 | Q9HCN6 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | RPA1 | P27694 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1487623 | 0.81 | MAOA (0.44) | ADH5GP6IDO1ALDH1A1LMNA | |
| SCHEMBL1010923 | 0.73 | MAOA (0.44) | ADH5GP6IDO1ALDH1A1LMNA | |
| SCHEMBL1010063 | 0.70 | KDM6B (0.36) | ALDH1A1 | |
| SCHEMBL8028066 | 0.68 | CHEK1 (0.46) | ADH5GP6IDO1ALDH1A1LMNA | |
| SCHEMBL4020702 | 0.67 | PRCP (0.65) | ALDH1A1 | |
| SCHEMBL4020963 | 0.67 | PRCP (0.65) | ALDH1A1 | |
| SCHEMBL4180199 | 0.64 | GP6 (0.66) | ADH5GP6IDO1ALDH1A1LMNA | |
| SCHEMBL9984638 | 0.63 | ADH5 (0.95) | ADH5GP6ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL16645309 | 0.63 | ADH5 (0.75) | ADH5ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL21941742 | 0.62 | ADH5 (0.61) | ADH5GP6IDO1ALDH1A1LMNA |
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-2054416-B1 | SUBSTITUTED PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE | MERZ PHARMA GMBH & CO KGAA (DE) | 2011-01-05 | — | — | EP | disclosed |