Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 7/20 | 0.34 |
| ▸ | CPS1 | P31327 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10361131 | 0.88 | TDP1 (0.38) | TDP1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10360360 | 0.83 | MAPT (0.39) | ALDH1A1CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL10361111 | 0.76 | TSHR (0.45) | ALDH1A1PPARG | |
| SCHEMBL10360631 | 0.76 | FPR2 (0.36) | ALDH1A1FFAR4 | |
| SCHEMBL10360298 | 0.74 | MAPT (0.42) | TDP1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10361138 | 0.74 | MAPT (0.39) | TDP1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10361364 | 0.74 | MAPT (0.42) | ALDH1A1KMT2A | |
| SCHEMBL10361114 | 0.73 | MAPT (0.39) | ALDH1A1CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL10361312 | 0.73 | MAPT (0.56) | ALDH1A1CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL10360667 | 0.73 | PPARD (0.39) | TDP1ALDH1A1CYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4931083-A | Plant growth regulating triazoles | ELI LILLY AND COMPANY (US) | 1990-06-05 | — | — | US | disclosed |
| EP-0227284-A1 | Plant Growth regulating triazoles | ELI LILLY AND COMPANY (US) | 1987-07-01 | — | — | EP | disclosed |