Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.49 |
| ▸ | HTR2A | P28223 | 3/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5275708 | 0.81 | CYP1A2 (0.67) | TAAR1HTR2AHTR2CCYP1A2HTR2B | |
| SCHEMBL14612683 | 0.80 | CA2 (0.41) | CYP1A2KMT2ACA2CA4MEN1 | |
| SCHEMBL4932262 | 0.79 | KMT2A (0.46) | CYP1A2KMT2ACA2CA4MEN1 | |
| SCHEMBL30930936 | 0.77 | CA2 (0.52) | KMT2ACA2CA4MEN1SMN1; SMN2 | |
| SCHEMBL9952090 | 0.76 | KMT2A (0.41) | CYP1A2KMT2ACA2CA4MEN1 | |
| Hydrochloric Acid SCHEMBL9952054 | 0.76 | TAAR1 (0.45) | TAAR1HTR2AHTR2CCYP1A2HTR2B | |
| SCHEMBL10265435 | 0.75 | KMT2A (0.50) | HTR2ACYP1A2KMT2ACA2CA4 | |
| SCHEMBL21198098 | 0.73 | THRB (0.47) | CYP1A2KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL31063395 | 0.73 | HTR1A (0.40) | HTR2ACYP1A2KMT2ACA2CA4 | |
| SCHEMBL9952029 | 0.73 | TAAR1 (0.46) | TAAR1HTR2AHTR2CCYP1A2HTR2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2655374-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | Incyte Corporation (US) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012087881-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2012-06-28 | — | — | WO | disclosed |