Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABHD6 | Q9BV23 | 3/20 | 0.38 |
| ▸ | NAMPT | P43490 | 2/20 | 0.36 |
| ▸ | PNMT | P11086 | 2/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 4/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | CARM1 | Q86X55 | 2/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.34 |
| ▸ | METAP1 | P53582 | 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 | |
|---|---|---|---|---|
| SCHEMBL2145007 | 0.73 | CARM1 (0.42) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| SCHEMBL15983781 | 0.66 | HSD17B3 (0.41) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| SCHEMBL1782140 | 0.66 | BRD4 (0.46) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| SCHEMBL18782916 | 0.66 | DPP8 (0.43) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| SCHEMBL578240 | 0.66 | HSD17B3 (0.55) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| SCHEMBL16126838 | 0.66 | ABHD6 (0.46) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| Bromide SCHEMBL14921932 | 0.65 | DPP8 (0.42) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| Hydrochloric Acid SCHEMBL7487148 | 0.65 | CYP19A1 (0.36) | ABHD6NAMPTHSD17B3DPP8DPP9 | |
| SCHEMBL31197682 | 0.64 | ABHD6 (0.44) | ABHD6NAMPTPNMTHSD17B3DPP8 | |
| SCHEMBL24502687 | 0.62 | MAOB (0.45) | ABHD6HSD17B3 |
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-2640366-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | Exelixis, Inc. (US) | 2013-09-25 | — | — | EP | disclosed |
| WO-2012068096-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-24 | — | — | WO | disclosed |