Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7994140 | 0.77 | CA2 (0.39) | CYP1A2CA2CHKAALDH1A1KDM4E | |
| SCHEMBL6543859 | 0.77 | ALDH1A1 (0.49) | ALDH1A1KDM4EMAPTPOLBTP53 | |
| SCHEMBL1127702 | 0.77 | ALDH1A1 (0.49) | ALDH1A1KDM4EMAPTPOLBTP53 | |
| SCHEMBL6508506 | 0.76 | CYP1A2 (0.37) | CYP1A2CA2CHKAALDH1A1KDM4E | |
| SCHEMBL3898636 | 0.76 | CA2 (0.36) | CYP1A2CA2CHKAALDH1A1KDM4E | |
| SCHEMBL6175645 | 0.76 | HSD11B1 (0.38) | CYP1A2CA2CHKAALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL6544280 | 0.75 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTPOLBTP53 | |
| SCHEMBL4609731 | 0.75 | CA2 (0.47) | CYP1A2CA2CHKAALDH1A1TP53 | |
| SCHEMBL4610760 | 0.75 | CA2 (0.47) | CYP1A2CA2CHKAALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL4609226 | 0.75 | CA2 (0.35) | CYP1A2CA2CHKAALDH1A1POLB |
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-2005047253-A1 | MELANOCORTIN RECEPTOR AGONISTS | LG LIFE SCIENCES LTD. (KR) | 2005-05-26 | — | — | WO | disclosed |