Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3721858 | 0.93 | GLA (0.43) | GLASMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL3717501 | 0.91 | GLA (0.39) | GLASMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL3719435 | 0.89 | TLR8 (0.37) | GLASMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL3723730 | 0.87 | SMN1; SMN2 (0.52) | GLASMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL3718570 | 0.87 | TSHR (0.38) | GLASMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL3717503 | 0.85 | KCNH2 (0.36) | GLASMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL3722047 | 0.85 | GLA (0.42) | GLASMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL3717217 | 0.85 | LMNA (0.36) | SMN1; SMN2TSHRKDM4EMEN1LMNA | |
| SCHEMBL3721082 | 0.83 | MTNR1A (0.53) | SMN1; SMN2MAPTSCN9APOLB | |
| SCHEMBL3720375 | 0.83 | MCHR1 (0.35) | — |
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 |