Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.35 |
| ▸ | IP6K1 | Q92551 | 5/20 | 0.33 |
| ▸ | IP6K3 | Q96PC2 | 5/20 | 0.33 |
| ▸ | IP6K2 | Q9UHH9 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | GCK | P35557 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5275224 | 1.00 | RAB9A (0.42) | RAB9AALOX5P4HTMESR1IP6K1 | |
| SCHEMBL22010721 | 0.77 | RAB9A (0.41) | RAB9AALOX5P4HTMESR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4777307 | 0.77 | RAB9A (0.41) | RAB9AALOX5P4HTMESR1IP6K1 | |
| SCHEMBL4771852 | 0.76 | RAB9A (0.46) | RAB9AALOX5P4HTMESR1ALDH1A1 | |
| SCHEMBL5276342 | 0.76 | RAB9A (0.46) | RAB9AALOX5P4HTMESR1ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL21963997 | 0.74 | RAB9A (0.36) | RAB9AALOX5P4HTMESR1ALDH1A1 | |
| SCHEMBL3888548 | 0.72 | ALDH1A1 (0.44) | RAB9AALOX5P4HTMALDH1A1KDM4E | |
| SCHEMBL3888550 | 0.72 | ALDH1A1 (0.44) | RAB9AALOX5P4HTMALDH1A1KDM4E | |
| SCHEMBL6219602 | 0.68 | RAB9A (0.45) | RAB9AALOX5P4HTMESR1ALDH1A1 | |
| SCHEMBL1254770 | 0.67 | BRD4 (0.42) | RAB9AALOX5P4HTMALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1973902-A2 | 3-HETEROCYCLYLACRYLAMIDE COMPOUNDS AS FABI INHIBITORS AND ANTIBACTERIAL AGENTS | Affinium Pharmaceuticals, Inc. (CA) | 2008-10-01 | — | — | EP | disclosed |
| WO-2007067416-A2 | HETEROCYCLYLACRYLAMIDE COMPOUNDS AS FABI INHIBITORS AND ANTIBACTERIAL AGENTS | AFFINIUM PHARMACEUTICALS, INC. (CA) | 2007-06-14 | — | — | WO | disclosed |