Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.57 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.55 |
| ▸ | HTR2A | P28223 | 2/20 | 0.54 |
| ▸ | HTR2B | P41595 | 2/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7319939 | 1.00 | SLC6A4 (0.57) | SLC6A4SLC6A3MCHR1HTR2AHTR2B | |
| SCHEMBL8019455 | 0.82 | MCHR1 (0.56) | SLC6A4SLC6A3MCHR1HTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL25415884 | 0.81 | HTR2A (0.55) | SLC6A4SLC6A3MCHR1HTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL25415886 | 0.81 | HTR2A (0.55) | SLC6A4SLC6A3MCHR1HTR2AHTR2B | |
| SCHEMBL2579539 | 0.79 | LMNA (0.72) | SLC6A4SLC6A3HTR2AHTR2BSIGMAR1 | |
| SCHEMBL6189047 | 0.78 | MCHR1 (0.57) | SLC6A4SLC6A3MCHR1HTR2AHTR2B | |
| SCHEMBL9646805 | 0.78 | TDP1 (0.61) | SLC6A4SLC6A3HTR2AHTR2BSIGMAR1 | |
| SCHEMBL6189048 | 0.78 | MCHR1 (0.57) | SLC6A4SLC6A3MCHR1HTR2AHTR2B | |
| SCHEMBL9646816 | 0.78 | TDP1 (0.61) | SLC6A4SLC6A3HTR2AHTR2BSIGMAR1 | |
| SCHEMBL7304622 | 0.78 | S1PR1 (0.67) | MCHR1LMNASMN1; SMN2CHRM3ALDH1A1 |
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-0542846-A1 | N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-05-26 | — | — | EP | disclosed |
| CN-1061963-A | Be used as the croak pyridine class of the 4-replacement of medicine | SMITH KLINE FRENCH LAB (GB) | 1992-06-17 | — | — | CN | disclosed |
| WO-1992002502-A1 | N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1992-02-20 | — | — | WO | disclosed |