Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6774777 | 0.92 | CA1 (0.45) | CA1CA2CA12CA4CA5A | |
| Hydrochloric Acid SCHEMBL27495770 | 0.90 | CA1 (0.43) | CA1CA2CA12CA4CA5A | |
| Furan SCHEMBL4498178 | 0.80 | TXNRD1 (0.40) | ALOX5ALDH1A1MAPTPOLBLMNA | |
| Furan SCHEMBL6753768 | 0.75 | TXNRD1 (0.42) | ALDH1A1MAPTPOLBLMNATSHR | |
| Furan SCHEMBL28992748 | 0.74 | KMT2A (0.43) | ALOX5ALDH1A1MAPTPOLBTSHR | |
| SCHEMBL28198347 | 0.73 | CA12 (0.45) | CA1CA2CA12CA4CA9 | |
| Phenylmethanesulfonamide SCHEMBL28922635 | 0.73 | CA2 (0.76) | CA1CA2CA12CA4CA5A | |
| SCHEMBL2376313 | 0.72 | ALDH1A1 (0.40) | ALOX5ALDH1A1MAPTPOLBLMNA | |
| SCHEMBL2376319 | 0.72 | ALDH1A1 (0.47) | ALDH1A1MAPTPOLBLMNATSHR | |
| SCHEMBL4016648 | 0.72 | EPHX2 (0.44) | ALOX5ALDH1A1MAPTPOLBLMNA |
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-6737435-B1 | ANTIINFLAMMATORY AGENTS; MONOCYTE CHEMOATTRACTANT PROTEIN-1 (MCP-1) DISEASES | ASTRAZENECA AB (SE) | 2004-05-18 | — | — | US | disclosed |