Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA3 | P07451 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9110910 | 0.81 | MCL1 (0.54) | HSD17B10KDM4ENPSR1ALDH1A1HPGD | |
| SCHEMBL11267450 | 0.79 | KDM4E (0.39) | HSD17B10KDM4ENPSR1ALDH1A1CA12 | |
| SCHEMBL7801303 | 0.77 | KDM4E (0.63) | HSD17B10KDM4ENPSR1ALDH1A1CA12 | |
| SCHEMBL2004907 | 0.76 | F2 (0.47) | HSD17B10KDM4EALDH1A1CA1CA2 | |
| SCHEMBL27859515 | 0.76 | TPMT (0.53) | HSD17B10KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL9056913 | 0.75 | CYP1A1 (0.49) | HSD17B10KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL10721874 | 0.75 | KDM4E (0.52) | HSD17B10KDM4ENPSR1ALDH1A1CA12 | |
| SCHEMBL4905793 | 0.75 | NPSR1 (0.49) | HSD17B10KDM4ENPSR1ALDH1A1CA12 | |
| SCHEMBL11005985 | 0.75 | CA1 (0.47) | HSD17B10KDM4ENPSR1ALDH1A1CA12 | |
| SCHEMBL8846922 | 0.75 | KDM4E (0.52) | HSD17B10KDM4ENPSR1ALDH1A1TRPV4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8557812-B2 | Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2013-10-15 | — | — | US | disclosed |
| US-8557812-B2 | Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2013-10-15 | — | — | US | disclosed |