Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 2/20 | 0.35 |
| ▸ | GABRD | O14764 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.35 |
| ▸ | GABRE | P78334 | 2/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.35 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.35 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 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 | |
|---|---|---|---|---|
| SCHEMBL2013052 | 0.80 | TAAR1 (0.47) | NT5ECDC7ROCK2MAP4K4PIM1 | |
| SCHEMBL2015782 | 0.78 | NT5E (0.36) | NT5EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL1515905 | 0.72 | MAOB (0.40) | LMNAHPGDCDK4CCND1HTT | |
| SCHEMBL2011676 | 0.68 | KDM4E (0.41) | NT5EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL2015005 | 0.68 | PIK3CD (0.44) | LMNAHPGDCDC7ROCK2MAP4K4 | |
| SCHEMBL24315366 | 0.67 | CYP2A6 (0.58) | LMNAHPGDCLK4MEN1KMT2A | |
| SCHEMBL19287091 | 0.66 | TAAR1 (0.65) | SRCTAAR1DRD2 | |
| SCHEMBL31464089 | 0.65 | CYP2A6 (0.50) | LMNAALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL2013731 | 0.65 | AR (0.36) | MEN1KMT2ADPP4KDM4EADORA2A | |
| SCHEMBL2718869 | 0.65 | NT5E (0.47) | NT5EHPGDCDC7ROCK2MAP4K4 |
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-2011075630-A1 | SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |