Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 6/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.45 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7609537 | 0.82 | PTGS2 (0.38) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| Phosphoric Acid SCHEMBL27934163 | 0.70 | AKR1C3 (0.55) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| SCHEMBL20640864 | 0.70 | PGK1 (0.62) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| SCHEMBL6037830 | 0.69 | PTGS2 (0.47) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| Phosphoric Acid SCHEMBL17156463 | 0.69 | PTGS2 (0.64) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| SCHEMBL602096 | 0.69 | PTGS2 (0.69) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| Ketoprofen SCHEMBL27575091 | 0.67 | PTGS1 (0.88) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| SCHEMBL29627562 | 0.67 | AKR1C3 (0.55) | PTGS1PTGS2MAPTALDH1A1HPGD | |
| SCHEMBL10910350 | 0.67 | TSHR (0.51) | MAPTALDH1A1HPGDHIF1ACYP3A4 | |
| SCHEMBL8061568 | 0.67 | AKR1B1 (0.41) | ALDH1A1HPGDLMNAHIF1AKDM4E |
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-6046180-A | NAALADase inhibitors | GUILFORD PHARMACEUTICALS INC. (US) | 2000-04-04 | — | — | US | disclosed |
| EP-0936914-A4 | — | — | 1999-08-25 | — | — | EP | disclosed |
| EP-0936914-A1 | HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS | GUILFORD PHARMACEUTICALS INC. (US) | 1999-08-25 | — | — | EP | disclosed |
| WO-1997048400-A1 | HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS | GUILFORD PHARMACEUTICALS INC. (US) | 1997-12-24 | — | — | WO | disclosed |