Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA5A | P35218 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8573814 | 0.88 | CA2 (0.50) | CA2CA1CA5ACA9CA12 | |
| SCHEMBL8578814 | 0.86 | KDM4E (0.40) | CA2CA1CA5ACA9KDM4E | |
| SCHEMBL8572740 | 0.85 | GSTO1 (0.42) | CA2CA1CA5ACA9CA12 | |
| SCHEMBL8583706 | 0.84 | CA2 (0.46) | CA2CA1CA5ACA9CA12 | |
| SCHEMBL8580028 | 0.83 | PDGFRB (0.39) | CA2CA1CA5ACA9KDM4E | |
| SCHEMBL8043521 | 0.83 | CA12 (0.49) | CA2CA1CA5ACA9CA12 | |
| SCHEMBL8838478 | 0.82 | KDM4E (0.41) | KDM4EMAPTALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL8573173 | 0.82 | TSHR (0.44) | CA2CA1CA5ACA9CA12 | |
| SCHEMBL8573125 | 0.82 | KDM4E (0.38) | CA2CA1CA5ACA9KDM4E | |
| SCHEMBL1763859 | 0.81 | SLC9A1 (0.42) | CA2CA1CA5ACA9KDM4E |
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 |