Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | CPB1 | P15086 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | TLR4 | O00206 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | DPP4 | P27487 | 3/20 | 0.46 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | CCR2 | P41597 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 2/20 | 0.45 |
| ▸ | SYK | P43405 | 1/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL23871461 | 1.00 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL3892622 | 1.00 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL18544476 | 1.00 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL18544185 | 1.00 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL18544213 | 1.00 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL24226875 | 0.91 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL3889255 | 0.91 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL23871744 | 0.91 | ALDH1A1 (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL22241959 | 0.91 | KMT2A (0.54) | ALDH1A1GAACPB1TSHRKMT2A | |
| SCHEMBL22241957 | 0.91 | KMT2A (0.54) | ALDH1A1GAACPB1TSHRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137616-B | Antibacterial agents comprising pyrazino [2,3-b ] [1,4] oxazin-3-ones or related ring systems | 葛兰素史克知识产权开发有限公司 | 2020-06-26 | — | — | CN | disclosed |
| WO-2017029602-A2 | COMPOUNDS FOR USE IN ANTIBACTERIAL APPLICATIONS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-02-23 | — | — | WO | disclosed |