Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1410819 | 0.86 | AKR1C3 (0.62) | AKR1C3ALDH1A1HDAC8HDAC2TBXAS1 | |
| SCHEMBL1410816 | 0.86 | AKR1C3 (0.62) | AKR1C3ALDH1A1HDAC8HDAC2TBXAS1 | |
| SCHEMBL6930239 | 0.85 | NOS3 (0.43) | AKR1C3ALDH1A1KDM4EHDAC8HDAC2 | |
| SCHEMBL12961218 | 0.84 | KMT2A (0.51) | AKR1C3ALDH1A1KDM4ETBXAS1GLA | |
| SCHEMBL9609509 | 0.79 | PTGS1 (0.47) | AKR1C3ALDH1A1POLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL10883401 | 0.79 | MAPT (0.54) | ALDH1A1KDM4ETDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL10883397 | 0.79 | MAPT (0.54) | ALDH1A1KDM4ETDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL4663123 | 0.79 | NOS3 (0.42) | ALDH1A1KDM4EHDAC8HDAC2HPGD | |
| SCHEMBL2439312 | 0.77 | AKR1C3 (0.48) | AKR1C3ALDH1A1KDM4EGLAPOLB | |
| SCHEMBL15272117 | 0.77 | ALDH1A1 (0.69) | AKR1C3ALDH1A1KDM4EGLAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1945621-B1 | PROCESS TO PREPARE AMINO ACID DERIVATIVES | REDDY S LAB EU LTD DR (GB) | 2009-04-15 | — | — | EP | disclosed |