Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | DBH | P09172 | 1/20 | 0.40 |
| ▸ | KDM4A | O75164 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6529174 | 0.83 | ALDH1A1 (0.47) | ALDH1A1KDM4EUSP2TDP1GAA | |
| SCHEMBL28206677 | 0.73 | ALDH1A1 (0.43) | ALDH1A1KDM4EUSP2HSD17B10TDP1 | |
| SCHEMBL8336583 | 0.72 | CYP19A1 (0.68) | ALDH1A1MAPTMEN1CYP1A2CYP3A4 | |
| SCHEMBL6530135 | 0.72 | CDK5 (0.50) | ALDH1A1KDM4EMAPTLMNAKDM4C | |
| SCHEMBL6528479 | 0.71 | LPO (0.51) | ALDH1A1KDM4EGAAMAPTLMNA | |
| SCHEMBL3976264 | 0.69 | GAA (0.47) | ALDH1A1USP2HSD17B10GAAMAPT | |
| SCHEMBL4573475 | 0.68 | ALDH1A1 (0.63) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL13143894 | 0.66 | TAAR1 (0.50) | ALDH1A1KDM4EUSP2HSD17B10TDP1 | |
| SCHEMBL29788845 | 0.66 | KMT2A (0.54) | ALDH1A1KDM4ETDP1GAAMAPT | |
| SCHEMBL28206691 | 0.66 | CYP19A1 (0.53) | ALDH1A1KDM4ETDP1GAAMAPT |
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 |