Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | DBH | P09172 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | QPCT | Q16769 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6530474 | 0.83 | ALDH1A1 (0.43) | ALDH1A1KDM4ETDP1DBHLMNA | |
| SCHEMBL6529662 | 0.78 | PHF8 (0.54) | ALDH1A1LMNAHTTGAAPHF8 | |
| SCHEMBL8336583 | 0.73 | CYP19A1 (0.68) | ALDH1A1QPCTMAPTCYP2D6 | |
| SCHEMBL3726218 | 0.73 | CYP19A1 (0.54) | ALDH1A1KDM4ETDP1MAPT | |
| SCHEMBL16549376 | 0.73 | QPCT (0.38) | ALDH1A1KDM4ELMNAQPCTGAA | |
| SCHEMBL6530144 | 0.71 | CDK5 (0.51) | ALDH1A1KDM4EQPCTGAAMAPT | |
| SCHEMBL3976264 | 0.70 | GAA (0.47) | ALDH1A1DBHLMNAGAAMAPT | |
| SCHEMBL19157912 | 0.70 | PHF8 (0.42) | QPCTP2RX7PHF8 | |
| SCHEMBL8066986 | 0.69 | PSEN1 (0.51) | — | |
| SCHEMBL15929449 | 0.69 | ALDH1A1 (0.51) | ALDH1A1KDM4ETDP1DBHLMNA |
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 |