Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ADH1B | P00325 | 1/20 | 0.41 |
| ▸ | ADH1C | P00326 | 1/20 | 0.41 |
| ▸ | ADH1A | P07327 | 1/20 | 0.41 |
| ▸ | ADH7 | P40394 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 2/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL165251 | 0.76 | LMNA (0.59) | TSHRADH1BADH1CADH1AADH7 | |
| SCHEMBL11571905 | 0.74 | LMNA (0.42) | ADH1BADH1CADH1AADH7LMNA | |
| SCHEMBL4658121 | 0.74 | ALDH1A1 (0.55) | LMNACYP2D6TAAR1ALDH1A1CYP3A4 | |
| SCHEMBL11322351 | 0.73 | TSHR (0.45) | TSHRLMNACYP2D6MEN1KMT2A | |
| SCHEMBL11328322 | 0.73 | TSHR (0.45) | TSHRLMNACYP2D6MEN1KMT2A | |
| SCHEMBL30804231 | 0.72 | TAAR1 (0.42) | TSHRADH1BADH1CADH1AADH7 | |
| SCHEMBL7267885 | 0.71 | CYP3A4 (0.54) | TSHRADH1BADH1CADH1AADH7 | |
| SCHEMBL9208385 | 0.71 | CYP2D6 (0.40) | LMNACYP2D6TAAR1SLC6A2ALDH1A1 | |
| SCHEMBL4991715 | 0.70 | SLC6A2 (0.45) | TSHRADH1BADH1CADH1AADH7 | |
| SCHEMBL17506734 | 0.70 | CYP3A4 (0.47) | TSHRADH1BADH1CADH1AADH7 |
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-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |