Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FUCA1 | P04066 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24438410 | 0.83 | FUCA1 (0.49) | FUCA1OPRL1GRIN2B | |
| SCHEMBL8873598 | 0.78 | MEN1 (0.46) | ACHEPOLB | |
| SCHEMBL15908896 | 0.77 | NPY1R (0.51) | FUCA1ALDH1A1OPRL1ACHEPOLB | |
| SCHEMBL6503563 | 0.76 | FUCA1 (0.56) | FUCA1ALDH1A1ACHEGRIN2BCYP1A2 | |
| SCHEMBL14157508 | 0.76 | FUCA1 (0.56) | FUCA1ALDH1A1ACHEGRIN2BCYP1A2 | |
| SCHEMBL6503566 | 0.76 | FUCA1 (0.56) | FUCA1ALDH1A1ACHEGRIN2BCYP1A2 | |
| SCHEMBL500532 | 0.76 | FUCA1 (0.56) | FUCA1ALDH1A1ACHEGRIN2BCYP1A2 | |
| SCHEMBL14157505 | 0.76 | FUCA1 (0.56) | FUCA1ALDH1A1ACHEGRIN2BCYP1A2 | |
| SCHEMBL15082004 | 0.76 | FUCA1 (0.56) | FUCA1ALDH1A1ACHEGRIN2BCYP1A2 | |
| SCHEMBL14157507 | 0.76 | FUCA1 (0.56) | FUCA1ALDH1A1ACHEGRIN2BCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011101409-A1 | PYRROLOPYRIMIDINE COMPOUNDS AS INHIBITORS OF CDK4/6 | NOVARTIS AG (CH) | 2011-08-25 | — | — | WO | disclosed |