Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 2/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 SCHEMBL11191332 | 0.99 | CYP2D6 (0.36) | CYP2D6CYP1A2DRD4L3MBTL1HTR1D | |
| SCHEMBL11187929 | 0.84 | CYP2D6 (0.37) | CYP2D6CYP1A2DRD4L3MBTL1ALDH1A1 | |
| SCHEMBL11189671 | 0.79 | CYP1A2 (0.46) | CYP2D6CYP1A2DRD4CRHBPCRHR2 | |
| SCHEMBL11187147 | 0.76 | L3MBTL1 (0.34) | CYP2D6L3MBTL1HTR1DHTR1BALDH1A1 | |
| SCHEMBL11180683 | 0.75 | ADRA2B (0.46) | CYP2D6CYP1A2LMNATSHR | |
| Hydrochloric Acid SCHEMBL11191316 | 0.75 | L3MBTL1 (0.33) | CYP2D6L3MBTL1HTR1DHTR1BALDH1A1 | |
| SCHEMBL11186543 | 0.74 | ALDH1A1 (0.54) | CYP1A2L3MBTL1ALDH1A1LMNACYP3A4 | |
| SCHEMBL11186437 | 0.74 | MEN1 (0.37) | CYP2D6CYP1A2L3MBTL1ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL9655776 | 0.70 | ALDH1A1 (0.44) | CYP2D6CYP1A2DRD4L3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9652319 | 0.69 | TP53 (0.44) | L3MBTL1ALDH1A1LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4420619-A | Imidazole urea and amido compounds | CIBA-GEIGY CORPORATION (US) | 1983-12-13 | — | — | US | disclosed |
| EP-0004561-B1 | UREA AND AMIDE DERIVATIVES, THEIR PREPARATION, PHARMACEUTICALS CONTAINING THEM AND THEIR USE FOR PREPARING PHARMACEUTICAL COMPOSITIONS | CIBA-GEIGY AG (CH) | 1981-11-04 | — | — | EP | disclosed |
| US-4292429-A | Imidazole urea and amido compounds | CIBA-GEIGY CORPORATION (US) | 1981-09-29 | — | — | US | disclosed |
| EP-0004561-A2 | Urea and amide derivatives, their preparation, pharmaceuticals containing them and their use for preparing pharmaceutical compositions | CIBA-GEIGY AG (CH) | 1979-10-17 | — | — | EP | disclosed |