Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CACNA1G | O43497 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9426845 | 0.92 | CYP2D6 (0.50) | HPGDPOLBCYP2D6CACNA1GTP53 | |
| SCHEMBL9321227 | 0.89 | POLB (0.49) | HPGDPOLBCACNA1GTP53HTR2A | |
| SCHEMBL9426050 | 0.88 | HTR2A (0.49) | HPGDPOLBTP53HTR2ATHRB | |
| SCHEMBL9425985 | 0.86 | THRB (0.51) | POLBTP53HTR2ATHRBLMNA | |
| Hydrochloric Acid SCHEMBL9426244 | 0.85 | AVPR2 (0.52) | POLBTP53HTR2ATHRBLMNA | |
| SCHEMBL9513197 | 0.82 | THRB (0.58) | POLBTP53HTR2ATHRBLMNA | |
| Hydrochloric Acid SCHEMBL9512922 | 0.81 | THRB (0.57) | POLBTP53HTR2ATHRBLMNA | |
| SCHEMBL9709938 | 0.80 | CACNA1G (0.59) | CACNA1GTP53THRBALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL9426740 | 0.79 | BCHE (0.49) | POLBLMNAALDH1A1MEN1KMT2A | |
| SCHEMBL9319916 | 0.79 | THRB (0.61) | POLBCYP2C9CACNA1GTP53HTR2A |
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-5321027-A | Analgesic | CIBA-GEIGY CORPORATION (US) | 1994-06-14 | — | — | US | disclosed |
| EP-0489690-A1 | Substituted N-Benzoyl-N'-(2-phenylethyl)-piperazines | CIBA-GEIGY AG (CH) | 1992-06-10 | — | — | EP | disclosed |