Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5308531 | 0.88 | CA12 (0.58) | KDM4EMAPTALDH1A1CA12CA1 | |
| SCHEMBL13291881 | 0.83 | TDP1 (0.46) | KDM4EMAPTALDH1A1ESR1LMNA | |
| SCHEMBL13291799 | 0.82 | TDP1 (0.53) | KDM4EMAPTALDH1A1CA12CA1 | |
| SCHEMBL13830583 | 0.81 | TDP1 (0.57) | MAPTALDH1A1CA12CA1CA2 | |
| SCHEMBL13291802 | 0.81 | HSD17B2 (0.51) | KDM4EMAPTHSD17B1HSD17B2NPC1 | |
| SCHEMBL13291808 | 0.78 | HSD17B1 (0.46) | KDM4EMAPTALDH1A1CA12CA1 | |
| SCHEMBL6063284 | 0.78 | ESR1 (0.52) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL13291800 | 0.77 | KDM4E (0.66) | KDM4EMAPTALDH1A1LMNANPC1 | |
| SCHEMBL13291805 | 0.77 | ALDH1A1 (0.47) | KDM4EMAPTALDH1A1CA12CA1 | |
| SCHEMBL8007058 | 0.76 | NPC1 (0.52) | KDM4EMAPTALDH1A1CA12CA1 |
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-7745424-B2 | Alkane diol derivatives as therapeutic agents for the treatment of bone conditions | The Univeristy Court of the University of Aberdeen (GB) | 2010-06-29 | — | — | US | disclosed |