Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | LAP3 | P28838 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | CPA1 | P15085 | 2/20 | 0.41 |
| ▸ | CPA3 | P15088 | 2/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
| ▸ | CPB1 | P15086 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7442261 | 0.82 | CYP1A2 (0.63) | CYP1A2SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL7442274 | 0.82 | CYP1A2 (0.63) | CYP1A2SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL7617301 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3 | |
| SCHEMBL21811160 | 0.80 | CYP1A2 (0.59) | CYP1A2LTA4HLAP3ALDH1A1CTRB1 | |
| Potassium Ion SCHEMBL9622463 | 0.78 | CYP1A2 (0.49) | CYP1A2LTA4HLAP3ALDH1A1CTRB1 | |
| Potassium Ion SCHEMBL9622154 | 0.78 | CYP1A2 (0.49) | CYP1A2LTA4HLAP3ALDH1A1CTRB1 | |
| SCHEMBL7354310 | 0.75 | CPA3 (0.66) | CYP1A2LTA4HALDH1A1CTRB1MAPK1 | |
| SCHEMBL17617234 | 0.75 | CYP1A2 (0.58) | CYP1A2LTA4HLAP3ALDH1A1CTRB1 | |
| SCHEMBL7289839 | 0.75 | CPA3 (0.66) | CYP1A2LTA4HALDH1A1CTRB1MAPK1 | |
| SCHEMBL8399603 | 0.75 | CPA3 (0.66) | CYP1A2LTA4HALDH1A1CTRB1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0994707-A4 | INHIBITORS OF NAALADASE ENZYME ACTIVITY | GUILFORD PHARM INC (US) | 2001-11-14 | — | — | EP | disclosed |
| EP-0994707-A1 | INHIBITORS OF NAALADASE ENZYME ACTIVITY | GUILFORD PHARMACEUTICALS INC. (US) | 2000-04-26 | — | — | EP | disclosed |
| WO-1998053812-A1 | INHIBITORS OF NAALADASE ENZYME ACTIVITY | GUILFORD PHARMACEUTICALS INC. (US) | 1998-12-03 | — | — | WO | disclosed |