Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 5/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.64 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.50 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7300823 | 0.90 | CYP2C9 (0.74) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL9340440 | 0.84 | ALOX15 (0.53) | HTR4ALOX15SMN1; SMN2HTT | |
| SCHEMBL7303858 | 0.83 | HTR4 (0.69) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL7292069 | 0.81 | CYP2C9 (0.78) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL7301885 | 0.80 | HTR4 (0.67) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL29397805 | 0.78 | HTR4 (1.00) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL1502039 | 0.78 | HTR4 (1.00) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL2940596 | 0.78 | CYP2C9 (0.94) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL29385613 | 0.78 | CYP2C9 (0.94) | HTR4CYP2C9PMP22NPSR1ALOX15 | |
| SCHEMBL7302574 | 0.77 | CYP2C9 (0.95) | HTR4CYP2C9PMP22NPSR1ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003097638-A1 | (S)-4-AMINO-5-CHLORO-2-METHOXY-N-[1-[1-(2-TETRAHYDROFURYLCARBONYL)-4-PIPERIDINYLMETHYL]-4-PIPERIDINYL]BENZAMIDE, PROCESS FOR THE PREPARATION THEREOF, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND INTERMEDIATE THEREFOR | DAINIPPON PHARMACEUTICAL CO., LTD. (JP) | 2003-11-27 | — | — | WO | disclosed |