Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | EDNRB | P24530 | 4/20 | 0.44 |
| ▸ | EDNRA | P25101 | 4/20 | 0.44 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | ACLY | P53396 | 1/20 | 0.42 |
| ▸ | BCL2 | P10415 | 1/20 | 0.41 |
| ▸ | BID | P55957 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP7 | P09237 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2732313 | 0.84 | HTR6 (0.39) | MEN1NPC1RAB9AKMT2AEDNRB | |
| SCHEMBL2732312 | 0.84 | HTR6 (0.39) | MEN1NPC1RAB9AKMT2AEDNRB | |
| SCHEMBL2733167 | 0.83 | HTR6 (0.40) | MEN1NPC1RAB9AKMT2AEDNRB | |
| SCHEMBL2732065 | 0.81 | HTR6 (0.42) | MEN1NPC1RAB9AKMT2AEDNRB | |
| SCHEMBL2733056 | 0.81 | HTR6 (0.42) | MEN1NPC1RAB9AKMT2AEDNRB | |
| SCHEMBL2731882 | 0.80 | HTR6 (0.48) | MEN1NPC1RAB9AKMT2AEDNRB | |
| SCHEMBL10065051 | 0.80 | PSEN1 (0.40) | MEN1KMT2AHTR6PSEN1PSEN2 | |
| SCHEMBL2886894 | 0.74 | HTR6 (0.63) | MEN1NPC1RAB9AKMT2AHTR6 | |
| SCHEMBL8857175 | 0.74 | EDNRA (0.62) | EDNRBEDNRA | |
| SCHEMBL10065013 | 0.72 | NOD2 (0.43) | MEN1KMT2AHTR6PSEN1PSEN2 |
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 |