Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 8/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6343955 | 0.82 | PARP10 (0.40) | CYP26A1CYP24A1CYP27A1 | |
| SCHEMBL4098450 | 0.79 | CYP24A1 (0.54) | CYP26A1CYP24A1CYP19A1CYP27A1DRD2 | |
| SCHEMBL6352009 | 0.79 | ACHE (0.47) | CYP19A1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL29365032 | 0.79 | ACHE (0.47) | CYP19A1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL18845473 | 0.71 | CYP19A1 (0.49) | CYP26A1CYP24A1CYP19A1CYP27A1GRIN2B | |
| SCHEMBL10333984 | 0.71 | CYP19A1 (0.48) | CYP26A1CYP24A1CYP19A1CYP27A1 | |
| SCHEMBL6341940 | 0.69 | HTR2C (0.39) | HTR2C | |
| SCHEMBL14013291 | 0.68 | MAPT (0.53) | CYP26A1CYP4F2CYP4A11CYP24A1CYP27A1 | |
| SCHEMBL7127913 | 0.68 | AKR1B1 (0.42) | S1PR1CYP4F2CYP4A11AKR1B1GRIN2B | |
| SCHEMBL4805957 | 0.68 | CASP1 (0.53) | AKR1B1 |
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-2008134035-A1 | ALPHA-UNSUBSTITUTED ARYLMETHYL PIPERAZINE PYRAZOLO[1,5-A] PYRIMIDINE AMIDE DERIVATIVES | PANACOS PHARMACEUTICALS, INC. (US) | 2008-11-06 | — | — | WO | disclosed |