Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 8/20 | 0.39 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9111977 | 0.99 | MEN1 (0.39) | MEN1NPC1RAB9AKMT2AACACB | |
| SCHEMBL9113516 | 0.87 | ACACB (0.40) | ACACBF2RL3PARP15PARP10 | |
| SCHEMBL9111699 | 0.84 | ACACA (0.49) | ACACB | |
| SCHEMBL9111316 | 0.83 | MEN1 (0.40) | MEN1NPC1RAB9AKMT2AACACB | |
| SCHEMBL9113488 | 0.83 | ACACB (0.48) | ACACB | |
| SCHEMBL9113673 | 0.83 | ACACB (0.56) | ACACB | |
| SCHEMBL9111214 | 0.82 | MIF (0.46) | MEN1NPC1RAB9AKMT2ASLC6A2 | |
| SCHEMBL9113010 | 0.81 | ACACB (0.47) | ACACB | |
| SCHEMBL9111434 | 0.81 | ACACB (0.49) | ACACB | |
| SCHEMBL22529599 | 0.80 | ACACB (0.42) | ACACBSLC6A2SLC6A4HTR3AKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2649062-B1 | BICYCLIC COMPOUNDS AS INHIBITORS OF ACETYL-COA CARBOXYLASE (ACC) | TAKEDA PHARMACEUTICAL (JP) | 2015-04-08 | — | — | EP | disclosed |