Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | RXRA | P19793 | 1/20 | 0.30 |
| ▸ | RXRB | P28702 | 1/20 | 0.30 |
| ▸ | RXRG | P48443 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10645189 | 0.68 | LATS1 (0.33) | TSHRKDM4ECYP1A2RXRARXRG | |
| Iodide SCHEMBL11855940 | 0.64 | GAA (0.32) | GAATSHR | |
| SCHEMBL4271535 | 0.64 | CHRM1 (0.35) | CHRM1 | |
| SCHEMBL22806989 | 0.63 | — | — | |
| SCHEMBL21807785 | 0.63 | CHRM1 (0.38) | TSHRCHRM1KDM4EMDM2CYP1A2 | |
| SCHEMBL3082762 | 0.62 | NPC1 (0.42) | GAACHRM1KDM4EMDM2CYP1A2 | |
| SCHEMBL4472253 | 0.62 | — | — | |
| SCHEMBL8060558 | 0.61 | CHRM1 (0.37) | TSHRCHRM1KDM4EMDM2CYP1A2 | |
| SCHEMBL4495310 | 0.61 | CYP1A2 (0.44) | GAATSHRCHRM1KDM4ECYP1A2 | |
| SCHEMBL12813387 | 0.61 | GAA (0.37) | GAATSHRCYP1A2RXRARXRB |
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 |
|---|---|---|---|---|---|---|---|
| US-4670109-A | ANODIC OXIDATION OF ALPHA-BETA UNSATURATED OXIMES | FIRMENICH SA (CH) | 1987-06-02 | — | — | US | claimed |