Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
| ▸ | GLS | O94925 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12986436 | 0.81 | NOS1 (0.42) | CYP3A4LOXL2 | |
| SCHEMBL14547332 | 0.68 | MASP2 (0.35) | ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL5752289 | 0.67 | AOC2 (0.58) | GFERALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL15651236 | 0.67 | CYP3A4 (0.43) | GFERALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL15651235 | 0.67 | CYP3A4 (0.43) | GFERALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL13003094 | 0.65 | — | — | |
| SCHEMBL10339088 | 0.63 | TDP1 (0.48) | GFERALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL1331730 | 0.63 | CA2 (0.62) | GFERALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL39103 | 0.63 | CA2 (0.62) | GFERALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL9256936 | 0.63 | ALDH1A1 (0.48) | GFERALDH1A1CYP3A4TSHRTDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005030704-A1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2005-04-07 | — | — | WO | disclosed |
| WO-2003024448-A2 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2003-03-27 | — | — | WO | disclosed |