Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | DGKA | P23743 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | PAM | P19021 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1201485 | 1.00 | CYP1A2 (0.48) | CYP1A2ALDH1A1ALOX15TDP1TSHR | |
| SCHEMBL11455382 | 1.00 | CYP1A2 (0.48) | CYP1A2ALDH1A1ALOX15TDP1TSHR | |
| SCHEMBL49063 | 0.93 | CYP1A2 (0.52) | CYP1A2ALDH1A1ALOX15TDP1TSHR | |
| SCHEMBL11443788 | 0.86 | DGKA (0.55) | ALDH1A1TSHRDGKAPRSS1PRSS2 | |
| SCHEMBL48378 | 0.85 | CYP1A2 (0.45) | CYP1A2ALDH1A1ALOX15TDP1TSHR | |
| SCHEMBL10451645 | 0.85 | DGKA (0.58) | ALDH1A1TSHRDGKAPRSS1PRSS2 | |
| SCHEMBL11438853 | 0.85 | DGKA (0.58) | ALDH1A1TSHRDGKAPRSS1PRSS2 | |
| SCHEMBL1174146 | 0.84 | DGKA (0.46) | ALDH1A1TSHRDGKAPRSS1PRSS2 | |
| SCHEMBL11577455 | 0.84 | PRSS1 (0.51) | ALDH1A1TSHRDGKAPRSS1PRSS2 | |
| SCHEMBL10392177 | 0.84 | PRSS1 (0.51) | ALDH1A1TSHRDGKAPRSS1PRSS2 |
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-4330550-A | ANTICOAGULANTS AND ANALGESICS | A. NATTERMANN & CIE. GMBH (DE) | 1982-05-18 | — | — | US | disclosed |