Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL13827488 | 0.94 | KDM1A (0.42) | SLC6A9KDM1AADRB2KDM4EGAA | |
| SCHEMBL13736151 | 0.89 | SLC6A9 (0.48) | SLC6A9KDM1AADRB2KDM4EGAA | |
| SCHEMBL13827430 | 0.85 | SLC6A9 (0.56) | SLC6A9CYP3A4KCNH2 | |
| SCHEMBL13827500 | 0.83 | SLC6A9 (0.44) | SLC6A9KDM1AADRB2 | |
| SCHEMBL15187753 | 0.83 | SLC6A9 (0.40) | SLC6A9KDM1AADRB2KDM4EGAA | |
| SCHEMBL17675759 | 0.82 | SLC6A9 (0.53) | SLC6A9GAABCHEACHEKCNH2 | |
| SCHEMBL13737473 | 0.81 | ADRB2 (0.48) | KDM1AADRB2KDM4EGAAMAPT | |
| SCHEMBL17675711 | 0.80 | SLC6A9 (0.55) | SLC6A9CYP3A4BCHEACHEKCNH2 | |
| SCHEMBL17675761 | 0.80 | SLC6A9 (0.53) | SLC6A9CYP3A4KCNH2 | |
| SCHEMBL13827332 | 0.79 | SLC6A9 (0.56) | SLC6A9CYP3A4ADRB2KCNH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9309200-B2 | Benzazepine derivatives, pharmaceutical compositions containing them, and their use in therapy | AbbVie Deutschland GmbH & Co. KG (DE) | 2016-04-12 | — | — | US | disclosed |
| US-9309200-B2 | Benzazepine derivatives, pharmaceutical compositions containing them, and their use in therapy | AbbVie Deutschland GmbH & Co. KG (DE) | 2016-04-12 | — | — | US | disclosed |
| WO-2012152915-A1 | BENZAZEPINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY | ABBOTT GMBH & CO. KG (DE) | 2012-11-15 | — | — | WO | disclosed |