Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | NAAA | Q02083 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.46 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7345822 | 0.78 | MAPK8 (0.66) | ALDH1A1 | |
| SCHEMBL4939073 | 0.77 | ALDH1A1 (0.71) | KDM4ETSHRHTTHPGDALDH1A1 | |
| SCHEMBL4042446 | 0.76 | TDP1 (0.55) | KDM4ETSHRALDH1A1MAPK1HSD17B10 | |
| SCHEMBL2506700 | 0.76 | CYP1A2 (0.52) | TSHRALDH1A1MAPK1HSD17B10NPSR1 | |
| SCHEMBL2657045 | 0.75 | KDM4C (0.56) | KDM4ETSHRALDH1A1MAPK1HSD17B10 | |
| SCHEMBL7369085 | 0.75 | MAPK8 (0.53) | KDM4EALDH1A1 | |
| SCHEMBL27571120 | 0.75 | NAAA (0.72) | NAAAHPGD | |
| SCHEMBL8597434 | 0.73 | NAAA (0.55) | KDM4ENAAATSHRHTTHPGD | |
| SCHEMBL3836252 | 0.73 | TSHR (0.57) | KDM4ENAAATSHRHTTHPGD | |
| SCHEMBL742273 | 0.73 | CTNNB1 (0.65) | KDM4ETSHRHTTALDH1A1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0357316-B1 | ANTIDEPRESSANT N-SUBSTITUTED NICOTINAMIDE COMPOUNDS | PFIZER INC. (US) | 1993-04-14 | — | — | EP | disclosed |
| EP-0357316-A1 | Antidepressant N-substituted nicotinamide compounds | PFIZER INC. (US) | 1990-03-07 | — | — | EP | disclosed |
| US-4861891-A | Antidepressant N-substituted nicotinamide compounds | PFIZER INC. (US) | 1989-08-29 | — | — | US | disclosed |