Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.67 |
| ▸ | DRD4 | P21917 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.57 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL4678438 | 0.84 | ACHE (0.63) | HPGDL3MBTL3L3MBTL1MGLLMEN1 | |
| SCHEMBL7302754 | 0.82 | NPC1 (0.72) | NPC1RAB9ADRD4TSHRLMNA | |
| SCHEMBL4310722 | 0.81 | TSHR (0.84) | NPC1RAB9ADRD4TSHRLMNA | |
| SCHEMBL27297526 | 0.81 | NPC1 (0.70) | NPC1RAB9ADRD4TSHRLMNA | |
| SCHEMBL10282916 | 0.80 | NPC1 (0.74) | NPC1RAB9ADRD4TSHRLMNA | |
| Hydrochloric Acid SCHEMBL4618408 | 0.79 | NPC1 (0.72) | NPC1RAB9ADRD4TSHRLMNA | |
| SCHEMBL17997522 | 0.78 | HRH3 (0.58) | NPC1RAB9AL3MBTL3L3MBTL1MEN1 | |
| SCHEMBL7218802 | 0.78 | HPGD (0.73) | NPC1RAB9ADRD4TSHRLMNA | |
| SCHEMBL7303743 | 0.77 | NPC1 (0.65) | NPC1RAB9ADRD4TSHRLMNA | |
| SCHEMBL7231605 | 0.77 | ACHE (0.70) | NPC1RAB9ADRD4CA12CA1 |
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-0934273-A1 | NEW DERIVATES FROM PIPERIDINE-KETO ACID, THEIR PREPARATION AND USE | BASF AKTIENGESELLSCHAFT (DE) | 1999-08-11 | — | — | EP | disclosed |
| WO-1998016512-A1 | NEW DERIVATES FROM PIPERIDINE-KETO ACID, THEIR PREPARATION AND USE | BASF AKTIENGESELLSCHAFT (DE) | 1998-04-23 | — | — | WO | disclosed |