Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | DRD5 | P21918 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3720365 | 0.86 | MAPT (0.41) | CYP1A2CYP3A4TSHRNFKB1APEX1 | |
| SCHEMBL3722576 | 0.84 | TLR8 (0.40) | CYP1A2CYP3A4TSHRNFKB1TAAR1 | |
| SCHEMBL3720042 | 0.83 | MAP4K4 (0.48) | SCN9A | |
| SCHEMBL3717827 | 0.83 | ALDH1A1 (0.49) | CYP1A2CYP3A4TSHRNFKB1APEX1 | |
| SCHEMBL3717202 | 0.81 | ACACB (0.38) | CYP1A2CYP3A4TSHRNFKB1APEX1 | |
| SCHEMBL3726204 | 0.80 | LOXL2 (0.49) | SCN9A | |
| SCHEMBL3720293 | 0.80 | GLA (0.42) | LMNAALDH1A1HTR1AHSD17B10TEC | |
| SCHEMBL3720117 | 0.79 | LMNA (0.39) | CYP1A2CYP3A4TSHRNFKB1APEX1 | |
| SCHEMBL3719857 | 0.79 | ALDH1A1 (0.37) | CYP3A4ALDH1A1HSD17B10 | |
| SCHEMBL3724515 | 0.78 | MTNR1A (0.58) | LMNAMEN1KMT2AKDM4EMAPT |
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 |