Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 2/20 | 0.47 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1474850 | 0.98 | PIM1 (0.46) | PIM1PIM2SIGMAR1NISCHALDH1A1 | |
| SCHEMBL19189093 | 0.89 | ALDH1A1 (0.47) | ALDH1A1GLANOTUMKDM4ECYP1A2 | |
| SCHEMBL10345634 | 0.84 | SIGMAR1 (0.45) | PIM1PIM2SIGMAR1ALDH1A1GLA | |
| Hydrochloric Acid SCHEMBL10345568 | 0.83 | SIGMAR1 (0.44) | PIM1PIM2SIGMAR1ALDH1A1GLA | |
| SCHEMBL1475629 | 0.83 | PIM1 (0.47) | PIM1PIM2SIGMAR1NISCHALDH1A1 | |
| SCHEMBL1477393 | 0.81 | PIM1 (0.44) | PIM1PIM2SIGMAR1ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL1474197 | 0.80 | PIM1 (0.43) | PIM1PIM2SIGMAR1ALDH1A1TDP1 | |
| SCHEMBL10345270 | 0.80 | PIM1 (0.51) | PIM1PIM2SIGMAR1NISCHALDH1A1 | |
| SCHEMBL2343249 | 0.77 | OPRM1 (0.41) | PIM1PIM2SIGMAR1NISCHALDH1A1 | |
| Hydrochloric Acid SCHEMBL1475684 | 0.77 | NISCH (0.39) | SIGMAR1NISCHALDH1A1GLANOTUM |
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-1484327-B1 | NITROGENOUS HETEROCYCLIC COMPOUND AND MEDICINE THEREOF | EISAI R&D MAN CO LTD (JP) | 2007-08-01 | — | — | EP | disclosed |