Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7491122 | 0.90 | MEN1 (0.35) | ALDH1A1MAPTHPGDSMN1; SMN2RECQL | |
| SCHEMBL6153144 | 0.88 | PPARG (0.35) | ALDH1A1HPGDMEN1KMT2ALMNA | |
| SCHEMBL7836265 | 0.85 | SLC7A5 (0.39) | ALDH1A1HPGDMEN1KMT2AKDM4E | |
| SCHEMBL7492036 | 0.82 | ALDH1A1 (0.40) | ALDH1A1MAPTHPGDSMN1; SMN2RECQL | |
| SCHEMBL6154669 | 0.82 | MEN1 (0.36) | ALDH1A1MAPTHPGDSMN1; SMN2RECQL | |
| SCHEMBL6946876 | 0.82 | TTR (0.35) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL6153461 | 0.82 | CYP4F2 (0.34) | ALDH1A1HPGDSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6949307 | 0.82 | CYP2C9 (0.32) | ALDH1A1MAPTHPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL6153189 | 0.81 | CYP2C9 (0.32) | ALDH1A1HPGDSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL7843083 | 0.81 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGDMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6131226-A | 2-SUBSTITUTED,3,5-BIS(METHOXYCARBONYL),4-(2,6-DIHALOPHENYL), 6-(1-((SUBSTITUTED)RING)PIPERAZIN-1,4-YLENE-CARBONYLMETHYL)-1, 4-DIHYDROPYRIDINES; FOR TREATING INFLAMMATION, PAIN, VIRAL INFECTIONS, CARDIOVASCULAR DISEASE, ALLERGIES, ASTHMA | PFIZER INC. (US) | 2000-10-17 | — | — | US | disclosed |