Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 10/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.39 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14544156 | 0.86 | SMN1; SMN2 (0.42) | DHFRSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL13490485 | 0.84 | DHFR (0.39) | DHFRSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL13490483 | 0.81 | CYP1A2 (0.50) | DHFRSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL171466 | 0.81 | MEN1 (0.44) | DHFRSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL13490590 | 0.78 | MEN1 (0.44) | DHFRSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL32677921 | 0.78 | MEN1 (0.52) | SMN1; SMN2NPC1RAB9ACYP2C19MEN1 | |
| SCHEMBL169428 | 0.78 | GRM5 (0.50) | DHFRSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL13490472 | 0.78 | MEN1 (0.43) | DHFRSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL171515 | 0.77 | KDM1A (0.43) | SMN1; SMN2NPC1RAB9ACYP2C19MEN1 | |
| SCHEMBL13490572 | 0.77 | P2RY12 (0.43) | SMN1; SMN2NPC1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2426120-A1 | Pyridyltetrahydropyridines and pyridylpiperidines, and method of manufacturing them | Fujifilm Finechemicals Co., Ltd. (JP) | 2012-03-07 | — | — | EP | disclosed |