Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3718486 | 0.89 | TSHR (0.37) | KDM4EATMCYP3A4TSHRCYP1A2 | |
| SCHEMBL3720741 | 0.88 | FFAR4 (0.36) | KDM4EATMCYP3A4TSHRCYP1A2 | |
| SCHEMBL3720774 | 0.87 | GLA (0.43) | KDM4EATMCYP3A4TSHRCYP1A2 | |
| SCHEMBL3719835 | 0.86 | FFAR4 (0.36) | KDM4EATMCYP3A4TSHRCYP1A2 | |
| SCHEMBL3717202 | 0.85 | ACACB (0.38) | CYP3A4TSHRCYP1A2NFKB1MEN1 | |
| SCHEMBL3717771 | 0.85 | MEN1 (0.37) | CYP3A4MEN1KMT2ALMNAMAPK1 | |
| SCHEMBL3719380 | 0.85 | RXRA (0.37) | CYP3A4TSHRCYP1A2NFKB1FFAR4 | |
| SCHEMBL3728649 | 0.84 | MTNR1A (0.55) | KDM4ECYP3A4CYP1A2MEN1KMT2A | |
| SCHEMBL3718570 | 0.84 | TSHR (0.38) | KDM4EATMCYP3A4TSHRCYP1A2 | |
| SCHEMBL3717016 | 0.82 | TSHR (0.37) | KDM4EATMCYP3A4TSHRCYP1A2 |
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 |