Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL17803356 | 1.00 | REN (0.39) | RENHTTEPHX2KCNA5PTPN1 | |
| SCHEMBL17803350 | 1.00 | REN (0.39) | RENHTTEPHX2KCNA5PTPN1 | |
| SCHEMBL19713508 | 1.00 | REN (0.39) | RENHTTEPHX2KCNA5PTPN1 | |
| SCHEMBL22006160 | 0.74 | REN (0.44) | RENKCNA5 | |
| SCHEMBL17803300 | 0.74 | REN (0.44) | RENKCNA5 | |
| SCHEMBL17803279 | 0.73 | KCNA5 (0.41) | RENKCNA5KDM4EMAPTKMT2A | |
| SCHEMBL17803282 | 0.73 | KCNA5 (0.41) | RENKCNA5KDM4EMAPTKMT2A | |
| SCHEMBL22006159 | 0.71 | REN (0.43) | RENEPHX2KCNA5SMN1; SMN2NPC1 | |
| SCHEMBL17803293 | 0.71 | REN (0.43) | RENEPHX2KCNA5SMN1; SMN2NPC1 | |
| SCHEMBL7607833 | 0.66 | ALDH1A1 (0.46) | KCNA5KDM4EALDH1A1MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3226690-B1 | NOVEL TRICYCLIC COMPOUNDS AS INHIBITORS OF MUTANT IDH ENZYMES | MERCK SHARP & DOHME (US) | 2020-05-20 | — | — | EP | disclosed |