Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.37 |
| ▸ | P4HTM | Q9NXG6 | 4/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | CSF1R | P07333 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.33 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3187466 | 0.76 | P4HTM (0.58) | GRIN2BP4HTMKEAP1 | |
| SCHEMBL16600991 | 0.73 | ALDH1A1 (0.46) | GRIN2BP4HTMPTGS2KEAP1CA12 | |
| SCHEMBL16600880 | 0.69 | GRIN2B (0.47) | GRIN2BP4HTMKEAP1CA12CA1 | |
| SCHEMBL23384070 | 0.68 | KMT2A (0.32) | — | |
| SCHEMBL31035753 | 0.65 | ALPL (0.50) | PTGS2KEAP1CA12CA1CA2 | |
| SCHEMBL2644058 | 0.65 | ALPL (0.50) | PTGS2KEAP1CA12CA1CA2 | |
| SCHEMBL13548255 | 0.65 | HPGD (0.46) | PTGS2KEAP1CA12CA1CA2 | |
| SCHEMBL23384069 | 0.65 | MMP2 (0.35) | PTGS2 | |
| SCHEMBL22819179 | 0.65 | KDM4A (0.33) | — | |
| SCHEMBL21485440 | 0.64 | GRIN2B (0.48) | GRIN2BP4HTMGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021097039-A1 | TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF | GILEAD SCIENCES, INC. (US) | 2021-05-20 | — | — | WO | disclosed |