Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 17/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 16/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 12/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6559791 | 0.77 | MCHR1 (0.47) | MC4RKCNH2CYP2D6LMNA | |
| SCHEMBL1441948 | 0.77 | LMNA (0.43) | SLC6A4SLC6A2SLC6A3KCNH2KDM4E | |
| SCHEMBL529544 | 0.76 | RPLP1 (0.36) | KCNH2 | |
| SCHEMBL529417 | 0.76 | RPLP1 (0.36) | KCNH2 | |
| SCHEMBL529996 | 0.74 | SLC6A4 (0.36) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL16597602 | 0.74 | NOS2 (0.41) | MC4RSLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL27808000 | 0.73 | TACR1 (0.40) | SLC6A4SLC6A2SLC6A3KCNH2CYP2D6 | |
| SCHEMBL27906127 | 0.73 | SLC6A4 (0.36) | MC4RSLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL5823064 | 0.72 | TACR1 (0.48) | MC4RSLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL5815706 | 0.71 | SLC6A2 (0.49) | MC4RSLC6A4SLC6A2SLC6A3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1450801-A2 | 2-AMINOQUINOLINE COMPOUNDS | Merck & Co., Inc. (US) | 2004-09-01 | — | — | EP | disclosed |
| WO-2003045313-A2 | 2-AMINOQUINOLINE COMPOUNDS | MERCK & CO. INC. (US) | 2003-06-05 | — | — | WO | disclosed |