Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10507615 | 0.88 | ALDH1A1 (0.41) | CPB2ALDH1A1TRPA1KMT2AMEN1 | |
| SCHEMBL9305715 | 0.86 | CPB2 (0.46) | CPB2ALDH1A1TRPA1CA1CA2 | |
| SCHEMBL11276526 | 0.85 | CA2 (0.48) | CPB2ALDH1A1TRPA1CA1CA2 | |
| SCHEMBL11276531 | 0.85 | CA2 (0.48) | CPB2ALDH1A1TRPA1CA1CA2 | |
| SCHEMBL3176263 | 0.84 | CA2 (0.52) | CPB2ALDH1A1CA1CA2KMT2A | |
| SCHEMBL5000143 | 0.84 | CPB2 (0.47) | CPB2ALDH1A1CA1CA2KMT2A | |
| SCHEMBL3845206 | 0.82 | CPB2 (0.50) | CPB2CA1CA2KMT2AMEN1 | |
| SCHEMBL15899433 | 0.81 | ALDH1A1 (0.45) | CPB2ALDH1A1TRPA1CA1CA2 | |
| SCHEMBL29171186 | 0.81 | CPB2 (0.49) | CPB2ALDH1A1TRPA1CA1CA2 | |
| SCHEMBL1147236 | 0.81 | CPB2 (0.49) | CPB2ALDH1A1TRPA1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013083058-A1 | PLATINUM TYPE COMPOUND WITH LEAVING GROUP BEING HYDROXY ACID DERIVATIVE CONTAINING AMINO GROUP OR ALKYL AMINO, AND PREPARATION METHOD AND USE THEREOF | 北京市丰硕维康技术开发有限责任公司 (CN) | 2013-06-13 | — | — | WO | disclosed |