Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19981130 | 0.79 | CTSA (0.41) | ALDH1A1TSHRLMNANPSR1HPGD | |
| SCHEMBL19981137 | 0.78 | S1PR1 (0.38) | ALDH1A1TSHRLMNANPSR1HPGD | |
| SCHEMBL24058743 | 0.77 | L3MBTL1 (0.46) | ALDH1A1TSHRLMNANPSR1HPGD | |
| SCHEMBL22676967 | 0.73 | LMNA (0.42) | ALDH1A1TSHRLMNANPSR1HPGD | |
| SCHEMBL24595230 | 0.73 | LMNA (0.42) | ALDH1A1TSHRLMNANPSR1HPGD | |
| SCHEMBL773983 | 0.72 | AKR1B1 (0.47) | ALDH1A1TSHRLMNAHPGDMAPT | |
| SCHEMBL1703767 | 0.71 | AKR1B1 (0.50) | TSHRSMN1; SMN2S1PR1NPC1 | |
| SCHEMBL775210 | 0.70 | S1PR1 (0.43) | ALDH1A1TSHRLMNAMAPTSMN1; SMN2 | |
| SCHEMBL22560026 | 0.70 | LMNA (0.62) | ALDH1A1TSHRLMNANPSR1HPGD | |
| SCHEMBL19981314 | 0.70 | ACLY (0.41) | TSHRLMNAHPGDMAPTSMN1; SMN2 |
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-2018051254-A1 | CYCLIC SUBSTITUTED-1,2,4-OXADIAZOLE COMPOUNDS AS IMMUNOMODULATORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2018-03-22 | — | — | WO | disclosed |