Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | LIPE | Q05469 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6499187 | 0.91 | THRB (0.38) | THRBPTGS2KMT2A | |
| SCHEMBL6496406 | 0.85 | — | — | |
| SCHEMBL6498524 | 0.81 | CA2 (0.33) | THRBKMT2A | |
| SCHEMBL2973791 | 0.78 | PTGS2 (0.39) | PTGS2KMT2ABCHEACHELIPE | |
| SCHEMBL6244342 | 0.74 | — | — | |
| SCHEMBL2973786 | 0.71 | PTGS2 (0.43) | THRBPTGS2KMT2A | |
| SCHEMBL3696885 | 0.70 | PTGS2 (0.33) | PTGS2KMT2A | |
| SCHEMBL6498534 | 0.70 | ALDH1A1 (0.42) | KMT2A | |
| SCHEMBL6497751 | 0.69 | — | — | |
| SCHEMBL3279020 | 0.69 | CYP1A2 (0.41) | THRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |