Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.54 |
| ▸ | DRD3 | P35462 | 4/20 | 0.54 |
| ▸ | PRKACA | P17612 | 1/20 | 0.47 |
| ▸ | PRKACG | P22612 | 1/20 | 0.47 |
| ▸ | PRKACB | P22694 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.40 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.40 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.40 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.40 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.40 |
| ▸ | CHRNG | P07510 | 1/20 | 0.40 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | CHRND | Q07001 | 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 | |
|---|---|---|---|---|
| SCHEMBL23472129 | 0.86 | DRD2 (0.64) | DRD2DRD3PRKACAPRKACGPRKACB | |
| SCHEMBL4378996 | 0.80 | DRD2 (0.50) | DRD2DRD3CYP19A1ABCC9ABCC8 | |
| SCHEMBL16412900 | 0.80 | DRD2 (0.50) | DRD2DRD3CYP19A1ABCC9ABCC8 | |
| SCHEMBL29813085 | 0.80 | DRD2 (0.50) | DRD2DRD3CYP19A1ABCC9ABCC8 | |
| SCHEMBL6540021 | 0.80 | DRD2 (0.50) | DRD2DRD3CYP19A1ABCC9ABCC8 | |
| SCHEMBL31332598 | 0.77 | DRD2 (0.51) | DRD2DRD3PRKACAPRKACGPRKACB | |
| SCHEMBL14869628 | 0.75 | DRD2 (0.76) | DRD2DRD3ABCC9ABCC8KCNJ11 | |
| SCHEMBL2962509 | 0.74 | TSHR (0.54) | DRD2DRD3HTR1A | |
| Hydrochloric Acid SCHEMBL31210148 | 0.73 | DRD2 (0.73) | DRD2DRD3ABCC9ABCC8KCNJ11 | |
| Hydrochloric Acid SCHEMBL26692355 | 0.73 | DRD2 (0.73) | DRD2DRD3ABCC9ABCC8KCNJ11 |
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-2751109-A1 | HETEROCYCLYLAMINES AS PI3K INHIBITORS | Incyte Corporation (US) | 2014-07-09 | — | — | EP | disclosed |
| WO-2013033569-A1 | HETEROCYCLYLAMINES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2013-03-07 | — | — | WO | disclosed |