Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL3863960 | 0.85 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2LMNATP53TAAR1 | |
| SCHEMBL6242051 | 0.82 | MLYCD (0.38) | ALDH1A1SMN1; SMN2LMNATP53TAAR1 | |
| SCHEMBL15330157 | 0.80 | ALDH1A1 (0.44) | ALDH1A1GLAKMT2AMAPTMEN1 | |
| SCHEMBL6975281 | 0.78 | F2 (0.41) | — | |
| SCHEMBL5252736 | 0.76 | NPSR1 (0.43) | ALDH1A1SMN1; SMN2LMNATP53ALOX5 | |
| SCHEMBL13831626 | 0.76 | SMN1; SMN2 (0.51) | ALDH1A1SMN1; SMN2LMNATP53TSHR | |
| SCHEMBL1532229 | 0.75 | RXFP1 (0.48) | ALDH1A1SMN1; SMN2TAAR1GLATSHR | |
| SCHEMBL13603918 | 0.74 | NPSR1 (0.44) | ALDH1A1SMN1; SMN2GLATSHRKMT2A | |
| SCHEMBL1561383 | 0.74 | NPSR1 (0.44) | ALDH1A1SMN1; SMN2GLATSHRKMT2A | |
| SCHEMBL15332332 | 0.74 | POLB (0.36) | ALDH1A1SMN1; SMN2LMNATP53ALOX5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108715583-A | A kind of synthetic method of indole derivatives | 盐城师范学院 | 2018-10-30 | — | — | CN | claimed |
| EP-1931645-A2 | N- (3-AMINO-QUINOXALIN-2-YL) -SULFONAMIDE DERIVATIVES AND THEIR USE AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | Exelixis, Inc. (US) | 2008-06-18 | — | — | EP | claimed |
| WO-2007044729-A2 | N- (3-AMINO-QUINOXALIN-2-YL) -SULFONAMIDE DERIVATIVES AND THEIR USE AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | EXELIXIS, INC. (US) | 2007-04-19 | — | — | WO | claimed |
| CN-108715583-A | A kind of synthetic method of indole derivatives | 盐城师范学院 | 2018-10-30 | — | — | CN | disclosed |