Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 4/20 | 0.36 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2486303 | 0.86 | GAA (0.42) | RAB9AKMT2ACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL2158016 | 0.80 | AVPR2 (0.36) | RAB9AMAPTKMT2ACYP1A2CYP3A4 | |
| SCHEMBL3257223 | 0.80 | KMT2A (0.43) | RAB9AKMT2ACYP2D6SMN1; SMN2 | |
| SCHEMBL3814717 | 0.71 | AVPR2 (0.35) | MAPTKCNMA1SCN9AKMT2ACYP1A2 | |
| SCHEMBL21056958 | 0.66 | TSHR (0.54) | ECE1KCNMA1TSHRLMNAMAPK1 | |
| SCHEMBL21056961 | 0.66 | TSHR (0.54) | ECE1KCNMA1TSHRLMNAMAPK1 | |
| SCHEMBL2158331 | 0.63 | TSHR (0.39) | CYP3A4SMN1; SMN2TSHRLMNA | |
| SCHEMBL2157812 | 0.63 | CYP1A2 (0.39) | MAPTCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL2158689 | 0.62 | CYP1A2 (0.40) | MAPTCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL19894123 | 0.62 | KCNMA1 (0.48) | RAB9AKCNMA1KMT2AHPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2363396-A1 | Thiophene derivatives as antiviral agents for flavivirus infection | Virochem Pharma Inc. (CA) | 2011-09-07 | — | — | EP | disclosed |