Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 5/20 | 0.47 |
| ▸ | MMP12 | P39900 | 5/20 | 0.47 |
| ▸ | MMP8 | P22894 | 3/20 | 0.47 |
| ▸ | MMP13 | P45452 | 3/20 | 0.47 |
| ▸ | MMP14 | P50281 | 3/20 | 0.47 |
| ▸ | MMP16 | P51512 | 3/20 | 0.47 |
| ▸ | MMP9 | P14780 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8058401 | 0.87 | CXCL8 (0.46) | CXCL8L3MBTL1TDP1KDM4EALDH1A1 | |
| SCHEMBL8061507 | 0.86 | CXCL8 (0.50) | MMP2MMP12MMP13MMP14MMP9 | |
| SCHEMBL7744722 | 0.82 | CXCL8 (0.44) | CXCL8TDP1PTGS1AKR1C3AKR1C2 | |
| SCHEMBL8046728 | 0.82 | CXCL8 (0.46) | CXCL8L3MBTL1POLBALDH1A1 | |
| SCHEMBL8061527 | 0.79 | MEN1 (0.45) | CXCL8TP53 | |
| SCHEMBL22321985 | 0.78 | ALDH1A1 (0.50) | ALDH1A1NPC1 | |
| SCHEMBL17892024 | 0.78 | ABCB1 (0.66) | MMP2MMP12MMP8MMP13MMP14 | |
| SCHEMBL8059158 | 0.78 | CXCL8 (0.44) | CXCL8L3MBTL1TDP1 | |
| SCHEMBL19094074 | 0.77 | CETP (0.41) | HSD17B10L3MBTL1USP2KDM4EALDH1A1 | |
| SCHEMBL8064063 | 0.77 | MMP2 (0.46) | MMP2MMP12MMP8MMP13MMP14 |
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 |