Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL564747 | 0.77 | CYP19A1 (0.49) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| SCHEMBL7520802 | 0.76 | ALDH1A1 (0.56) | TDP1CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7693338 | 0.76 | ELANE (0.47) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| SCHEMBL9387868 | 0.76 | CYP19A1 (0.47) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| SCHEMBL163578 | 0.76 | ALDH1A1 (0.50) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| SCHEMBL6592746 | 0.76 | CYP19A1 (0.47) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| SCHEMBL4888627 | 0.74 | CYP19A1 (0.46) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| Bicarbonate SCHEMBL27510048 | 0.74 | ALDH1A1 (0.49) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| SCHEMBL2788102 | 0.74 | ALDH1A1 (0.49) | CYP19A1ELANEPRSS1PRSS2PRSS3 | |
| SCHEMBL81292 | 0.73 | NPSR1 (0.48) | ELANEMAPTTDP1KDM4ECYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1169328-A2 | AVERMECTIN DERIVATIVES | Bayer Aktiengesellschaft (DE) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000058328-A2 | AVERMECTIN DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-10-05 | — | — | WO | disclosed |