Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | FADS1 | O60427 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.37 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | CCND3 | P30281 | 1/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9686196 | 0.81 | MAPT (0.61) | MAPTCYP1A2KDM4ESMN1; SMN2L3MBTL1 | |
| SCHEMBL9563510 | 0.81 | MAPT (0.56) | MAPTCYP1A2KDM4ESMN1; SMN2L3MBTL1 | |
| SCHEMBL10948187 | 0.78 | KEAP1 (0.63) | KEAP1MAPTLMNAFADS1POLB | |
| SCHEMBL18393201 | 0.76 | CYP1A2 (0.41) | MAPTCYP1A2KDM4ESMN1; SMN2L3MBTL1 | |
| SCHEMBL29611914 | 0.76 | KEAP1 (0.67) | KEAP1MAPTLMNAFADS1POLB | |
| SCHEMBL2473546 | 0.76 | KEAP1 (0.67) | KEAP1MAPTLMNAFADS1POLB | |
| SCHEMBL3164756 | 0.75 | LMNA (0.54) | MAPTCYP1A2SMN1; SMN2LMNACES2 | |
| SCHEMBL9563517 | 0.75 | MAPT (0.58) | MAPTCYP1A2KDM4ESMN1; SMN2L3MBTL1 | |
| SCHEMBL28321855 | 0.73 | NTRK1 (0.44) | MAPTCYP1A2KDM4ESMN1; SMN2L3MBTL1 | |
| SCHEMBL344086 | 0.72 | LTA4H (0.58) | KEAP1MAPTLMNAFADS1POLB |
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-0552665-A1 | Pyrrolylbenzodiazepinones and medicines containing them | F. HOFFMANN-LA ROCHE AG (CH) | 1993-07-28 | — | — | EP | disclosed |