Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | NCF1 | P14598 | 1/20 | 0.42 |
| ▸ | PGK1 | P00558 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | NQO1 | P15559 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL28155719 | 0.86 | NCF1 (0.54) | HTR1ANCF1KCNH2NQO1MAPT | |
| SCHEMBL3720102 | 0.76 | PDE10A (0.47) | SLC6A4HTR2ASLC6A2SLC6A3NCF1 | |
| SCHEMBL3717395 | 0.75 | HDAC1 (0.42) | SLC6A4HTR2ASLC6A2SLC6A3NCF1 | |
| SCHEMBL3717394 | 0.75 | HDAC8 (0.44) | NCF1KCNH2NQO1MAPTTP53 | |
| SCHEMBL31330488 | 0.74 | HTR1A (0.55) | HTR1ANCF1NQO1 | |
| SCHEMBL9881019 | 0.74 | PDE3B (0.48) | NCF1MAPTTP53ALDH1A1POLB | |
| SCHEMBL3726423 | 0.73 | MTNR1A (0.47) | PDE10A | |
| SCHEMBL9881000 | 0.72 | HTR3A (0.42) | MAPTALDH1A1KDM4E | |
| SCHEMBL3726420 | 0.71 | ACACB (0.47) | SLC6A4HTR2AKCNH2 | |
| SCHEMBL3723729 | 0.69 | RORC (0.40) | HTR2APGK1GSK3BMAP4K2KCNH2 |
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-2010127208-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | disclosed |