Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA3 | P07451 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA6 | P23280 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.44 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.37 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.37 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8577707 | 0.88 | MCL1 (0.48) | MCL1CA12CA1CA2CA3 | |
| SCHEMBL8574456 | 0.85 | GSTO1 (0.40) | MCL1CA1CA2CA5ACA9 | |
| SCHEMBL8576928 | 0.84 | MCL1 (0.45) | MCL1CA12CA1CA2CA3 | |
| SCHEMBL8574763 | 0.83 | CA12 (0.65) | MCL1CA12CA1CA2CA3 | |
| SCHEMBL8574020 | 0.82 | CA12 (0.46) | MCL1CA12CA1CA2CA3 | |
| SCHEMBL8576406 | 0.82 | MCL1 (0.43) | MCL1GSTO1ALDH1A1MEN1KMT2A | |
| SCHEMBL8575404 | 0.77 | MCL1 (0.46) | MCL1CA12CA1CA2CA3 | |
| SCHEMBL8572725 | 0.76 | LCK (0.56) | MCL1CA12CA1CA2CA3 | |
| SCHEMBL8578495 | 0.75 | MCL1 (0.47) | MCL1GSTO1ALDH1A1MEN1KMT2A | |
| SCHEMBL8572740 | 0.72 | GSTO1 (0.42) | MCL1CA12CA1CA2CA3 |
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-5849796-A | Ortho-substituted benzoil acid derivatives | MERCK PATENT GELSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-12-15 | — | — | US | disclosed |