Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.51 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 7/20 | 0.49 |
| ▸ | ABCC1 | P33527 | 6/20 | 0.49 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.45 |
| ▸ | DHFR | P00374 | 1/20 | 0.45 |
| ▸ | HNF4A | P41235 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | DTYMK | P23919 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27985266 | 0.87 | DTYMK (0.58) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| SCHEMBL25302339 | 0.84 | ABCB1 (0.52) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| SCHEMBL8372988 | 0.84 | CRHBP (0.51) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| SCHEMBL8372989 | 0.82 | CRHBP (0.53) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| Acetamide SCHEMBL2368476 | 0.80 | DTYMK (0.51) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| SCHEMBL31232900 | 0.79 | CRHBP (0.46) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| SCHEMBL3325012 | 0.77 | ALDH1A1 (0.63) | ALDH1A1TDP1MAPT | |
| SCHEMBL1663325 | 0.77 | CRHBP (0.63) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| SCHEMBL8365480 | 0.77 | ABCB1 (0.49) | CRHBPCRHR2ABCB1ABCC1KCNMA1 | |
| SCHEMBL15847247 | 0.77 | ALDH1A1 (0.51) | ABCB1ABCC1POLBALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101970429-B | 2-amino-quinoline derivatives useful as inhibitors of beta-secretase (bace) | JANSSEN PHARMACEUTICA NV | 2013-05-29 | — | — | CN | disclosed |