Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | TRPC6 | Q9Y210 | 3/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 1/20 | 0.34 |
| ▸ | HPGDS | O60760 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL27964794 | 0.88 | DDB1 (0.39) | DDB1CRBNDHFRTRPC6NAMPT | |
| SCHEMBL7303971 | 0.85 | SLC18A3 (0.42) | DDB1CRBNGPR119KDM4EMAPT | |
| SCHEMBL15939963 | 0.81 | DDB1 (0.58) | DDB1CRBNGPR119KDM4EMAPT | |
| SCHEMBL14764554 | 0.81 | ALOX5AP (0.39) | TRPC6GPR119KDM4EMAPTTHRB | |
| SCHEMBL14764202 | 0.81 | TRPC6 (0.51) | TRPC6 | |
| SCHEMBL14764325 | 0.79 | GPR119 (0.36) | DDB1CRBNTRPC6GPR119 | |
| SCHEMBL14763960 | 0.78 | GPR119 (0.34) | TRPC6GPR119KDM4EMAPTTHRB | |
| SCHEMBL187122 | 0.76 | P2RY14 (0.41) | GPR119MAPTNAMPTKMT2A | |
| SCHEMBL14764140 | 0.76 | KDM5A (0.41) | DDB1CRBNPIK3CAMTOREGFR | |
| SCHEMBL27900299 | 0.75 | TRPC6 (0.47) | DDB1CRBNTRPC6KDM4ENAMPT |
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-2013034238-A1 | BENZONITRILE DERIVATIVES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2013-03-14 | — | — | WO | disclosed |