Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL231045 | 0.87 | ALDH1A1 (0.40) | ALDH1A1CYP3A4CYP2C19CPB2GAA | |
| SCHEMBL28182020 | 0.87 | ALDH1A1 (0.43) | ALDH1A1CYP3A4CYP2C19CA1CPB2 | |
| SCHEMBL7854404 | 0.84 | CA1 (0.38) | ALDH1A1CA1LMNAKMT2AMEN1 | |
| SCHEMBL1722216 | 0.83 | CA1 (0.48) | ALDH1A1CYP3A4CYP2C19CA1LMNA | |
| SCHEMBL15800111 | 0.83 | CA1 (0.48) | ALDH1A1CYP3A4CYP2C19CA1LMNA | |
| SCHEMBL27533711 | 0.82 | ALDH1A1 (0.45) | ALDH1A1CYP2C19CA1LMNATDP1 | |
| SCHEMBL14616914 | 0.82 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2C19CPB2GAA | |
| Hydrochloric Acid SCHEMBL29047451 | 0.81 | CA1 (0.47) | ALDH1A1CYP3A4CYP2C19CA1LMNA | |
| SCHEMBL1255707 | 0.81 | TDP1 (0.50) | ALDH1A1CPB2LMNAHSD17B10KMT2A | |
| SCHEMBL16298859 | 0.81 | CA1 (0.57) | CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5843951-A | Analgesic composition of pyrazolo(1,5-A) pyrimidines | OTSUKA PHARMACEUTICAL FACTORY INC. (JP) | 1998-12-01 | — | — | US | disclosed |
| CN-1169149-A | Analgesic composition | OTSUKA PHARMA CO LTD (JP) | 1997-12-31 | — | — | CN | disclosed |
| EP-0795555-A1 | ANALGESICS | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1997-09-17 | — | — | EP | disclosed |
| US-4188403-A | Cyclopentan-1-amines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-02-12 | — | — | US | disclosed |