Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PPM1B | O75688 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TET2 | Q6N021 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL631270 | 0.77 | ALDH1A1 (0.56) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| SCHEMBL2804787 | 0.77 | CYP1A2 (0.38) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| SCHEMBL1333228 | 0.77 | ALDH1A1 (0.56) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| SCHEMBL29000169 | 0.74 | KMT2A (0.50) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| Ethylene Glycol SCHEMBL29002151 | 0.73 | ALDH1A1 (0.51) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| SCHEMBL26623694 | 0.73 | ALDH1A1 (0.35) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| SCHEMBL1081993 | 0.72 | PTGS1 (0.38) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| SCHEMBL17442873 | 0.70 | ALDH1A1 (0.33) | CYP1A2ALDH1A1PKMCYP2C19KDM4E | |
| SCHEMBL27500201 | 0.70 | ALDH1A1 (0.33) | CYP1A2ALDH1A1PKMCYP2C19KMT2A | |
| SCHEMBL8530129 | 0.70 | ALDH1A1 (0.36) | CYP1A2ALDH1A1PKMCYP2C19NFKB1 |
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-5869448-A | INHIBIT BINDING BETWEEN VLA-4 RECEPTOR AND FIBRONECTIN CS-1 PEPTIDES; TREATING IMMUNOINFLAMMATORY CONDITIONS | CYTEL CORPORATION (US) | 1999-02-09 | — | — | US | disclosed |
| US-5811391-A | INHIBITS BINDING BETWEEN THE VLA-4 RECEPTOR EXPRESSED ON INFLAMMATORY LEUKOCYTES AND A FIBRONECTIN; ANTIINFLAMMATORY AND-ARTHRITIC AGENTS; ASTHMA; OLIGOPEPTIDES | CYTEL CORPORATION (US) | 1998-09-22 | — | — | US | disclosed |
| EP-0777681-A2 | CYCLIC CS-1 PEPTIDOMIMETICS, COMPOSITIONS AND METHODS OF USING THE SAME | CYTEL CORPORATION (US) | 1997-06-11 | — | — | EP | disclosed |
| WO-1996006108-A2 | CYCLIC CS-1 PEPTIDOMIMETICS, COMPOSITIONS AND METHODS OF USING THE SAME | CYTEL CORPORATION (US) | 1996-02-29 | — | — | WO | disclosed |