Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.70 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.70 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.70 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.70 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.69 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.69 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.69 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8638223 | 0.99 | APOBEC3A (0.71) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 | |
| SCHEMBL7753746 | 0.87 | MEN1 (0.54) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL8634641 | 0.86 | MEN1 (0.53) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 | |
| SCHEMBL7756364 | 0.85 | CHRM2 (0.72) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 | |
| SCHEMBL7757929 | 0.84 | MEN1 (0.62) | MEN1KMT2ACYP2C19KDM4EALDH1A1 | |
| Trimetazidine SCHEMBL29375563 | 0.84 | CHRM2 (1.00) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 | |
| Trimetazidine SCHEMBL230374 | 0.84 | CHRM2 (1.00) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 | |
| Trimetazidine SCHEMBL11846840 | 0.84 | CHRM2 (1.00) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL8640756 | 0.83 | MEN1 (0.61) | APOBEC3ACTDSP1APOBEC3GMEN1KMT2A | |
| Trimetazidine SCHEMBL2901538 | 0.82 | APOBEC3A (1.00) | CYP1A2CHRM2SLC6A4OPRD1OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0847999-B1 | N-benzylpiperazine derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 2001-03-21 | — | — | EP | disclosed |
| EP-0847999-A1 | N-benzylpiperazine derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1998-06-17 | — | — | EP | disclosed |