Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 9/20 | 0.43 |
| ▸ | CA2 | P00918 | 9/20 | 0.43 |
| ▸ | CA12 | O43570 | 6/20 | 0.43 |
| ▸ | CA7 | P43166 | 6/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.43 |
| ▸ | CA9 | Q16790 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7248144 | 1.00 | CA1 (0.43) | CA1CA2CA12CA7CA14 | |
| SCHEMBL6881171 | 0.81 | CA1 (0.50) | CA1CA2CA12CA7CA14 | |
| SCHEMBL4607263 | 0.80 | CA1 (0.43) | CA1CA2CA12CA7CA14 | |
| SCHEMBL7568637 | 0.78 | KDM4E (0.49) | KDM4EMTNR1AMTNR1BLMNAGAA | |
| SCHEMBL7254509 | 0.78 | LMNA (0.43) | KDM4EMTNR1AMTNR1BLMNAGAA | |
| SCHEMBL7254514 | 0.78 | LMNA (0.43) | KDM4EMTNR1AMTNR1BLMNAGAA | |
| SCHEMBL7248408 | 0.78 | KDM4E (0.49) | KDM4EMTNR1AMTNR1BLMNAGAA | |
| SCHEMBL4124063 | 0.78 | CA1 (0.39) | CA1CA2CA12CA7CA14 | |
| SCHEMBL29189280 | 0.77 | CA1 (0.53) | CA1CA2CA12CA7CA14 | |
| SCHEMBL4607688 | 0.76 | MAPT (0.45) | CA1CA2CA12CA7CA14 |
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-6462234-B2 | FORMED BY REACTING O-ETHYL-L-TYROSINE WITH TRIFLUOROACETIC ANHYDRIDE, REACTING WITH LEWIS ACID, THEN QUENCHING WITH WATER | PHARMACIA & UPJOHN COMPANY | 2002-10-08 | — | — | US | claimed |