Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.39 |
| ▸ | S100A4 | P26447 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6812640 | 0.82 | TDP1 (0.52) | MEN1KMT2AMAPTTDP1CA2 | |
| SCHEMBL29273179 | 0.78 | ERN1 (0.49) | ERN1MEN1KMT2AMAPTGAA | |
| SCHEMBL3651738 | 0.78 | ERN1 (0.49) | ERN1MEN1KMT2AMAPTTDP1 | |
| SCHEMBL27974918 | 0.75 | TDP1 (0.52) | ERN1MEN1KMT2AMAPTTDP1 | |
| SCHEMBL29410319 | 0.75 | SOS1 (0.56) | ERN1MEN1KMT2AMAPTNPC1 | |
| SCHEMBL125015 | 0.75 | SOS1 (0.56) | ERN1MEN1KMT2AMAPTNPC1 | |
| SCHEMBL28104917 | 0.75 | TSHR (0.56) | MEN1KMT2AMAPTNPC1TDP1 | |
| SCHEMBL1130962 | 0.75 | VCAM1 (0.53) | MEN1KMT2AMAPTGAATDP1 | |
| SCHEMBL28163932 | 0.75 | KMT2A (0.47) | MEN1KMT2ATDP1CA2CA5A | |
| SCHEMBL9422617 | 0.74 | GPR35 (0.53) | ERN1MEN1KMT2AMAPTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4994612-A | Intermediates for dihydropyridine derivatives | HOFFMANN-LA ROCHE INC. (US) | 1991-02-19 | — | — | US | disclosed |
| US-4847273-A | CARDIOVASCULAR DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1989-07-11 | — | — | US | disclosed |