Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 9/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.37 |
| ▸ | FNTA | P49354 | 1/20 | 0.37 |
| ▸ | FNTB | P49356 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9759954 | 0.82 | PTGS1 (0.40) | PTGS1PTGS2BCHEMAPTNOX1 | |
| SCHEMBL9759522 | 0.79 | PTGS1 (0.37) | PTGS1PTGS2BCHEMAPTFNTA | |
| SCHEMBL9759527 | 0.79 | PTGS1 (0.37) | PTGS1PTGS2BCHEMAPTFNTA | |
| SCHEMBL9331534 | 0.77 | LMNA (0.46) | PTGS1PTGS2BCHEMAPTCYP2D6 | |
| SCHEMBL4595129 | 0.68 | MAOA (0.48) | PTGS1PTGS2BCHEMAPTCYP2D6 | |
| SCHEMBL12386881 | 0.66 | PTGS1 (0.51) | PTGS1PTGS2BCHEMAPTCYP2D6 | |
| SCHEMBL29960525 | 0.66 | MAOA (0.34) | BCHEMAPTNOX1FNTAFNTB | |
| SCHEMBL8142099 | 0.65 | PTGS1 (0.59) | PTGS1PTGS2BCHEMAPTNOX1 | |
| SCHEMBL23954417 | 0.65 | MAOA (0.38) | NOX1TSHRMAOAKDM4EALDH1A1 | |
| SCHEMBL28842814 | 0.65 | KDM4E (0.36) | BCHEMAPTNOX1FNTAFNTB |
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 |
|---|---|---|---|---|---|---|---|
| US-5049669-A | Also diuretics | RHONE-POULENC SANTE (FR) | 1991-09-17 | — | — | US | disclosed |
| US-4985419-A | Analgesics, Diuretics | RHONE-POULENC SANTE (FR) | 1991-01-15 | — | — | US | disclosed |