Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 4/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 5/20 | 0.36 |
| ▸ | FABP3 | P05413 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 1/20 | 0.34 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2733172 | 0.84 | ACLY (0.37) | ACLYAGTR1AVPR1AHTR6FABP3 | |
| SCHEMBL2726604 | 0.84 | ACLY (0.41) | ACLYAGTR1HTR6FABP3FABP4 | |
| SCHEMBL2732065 | 0.77 | HTR6 (0.42) | ACLYHTR6PSEN1PSEN2APH1B | |
| SCHEMBL2733056 | 0.77 | HTR6 (0.42) | ACLYHTR6PSEN1PSEN2APH1B | |
| SCHEMBL2733167 | 0.73 | HTR6 (0.40) | ACLYHTR6PSEN1PSEN2APH1B | |
| SCHEMBL4119321 | 0.68 | ACLY (0.51) | ACLYAGTR1AVPR1AHTR6FABP3 | |
| SCHEMBL2732076 | 0.68 | FABP3 (0.50) | ACLYAGTR1HTR6FABP3FABP4 | |
| SCHEMBL28019783 | 0.68 | AGTR1 (0.47) | ACLYAGTR1HTR6FABP3FABP4 | |
| SCHEMBL6829775 | 0.68 | AKR1C3 (0.48) | ACLYAGTR1AVPR1AHTR6FABP3 | |
| SCHEMBL8188816 | 0.67 | AGTR1 (0.66) | ACLYAGTR1HTR6PSEN1PSEN2 |
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-2012059568-A1 | NOVEL WATER-SOLUBLE INDOLOBENZAZEPINE MOLECULES DEMONSTRATING ANTIMITOTIC, ANTIVASCULAR, AND ANTITUMOR ACTIVITIES IN VIVO | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2012-05-10 | — | — | WO | disclosed |