Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | TFEB | P19484 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1157682 | 0.79 | NFE2L2 (0.53) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL27751564 | 0.78 | NFE2L2 (0.52) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL8879885 | 0.76 | NFE2L2 (0.53) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL1759513 | 0.76 | NFE2L2 (0.53) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL28020798 | 0.76 | NFE2L2 (0.50) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL5609734 | 0.74 | NFE2L2 (0.48) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL6158467 | 0.74 | NFE2L2 (0.48) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL9541229 | 0.74 | TSHR (0.46) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL8412532 | 0.73 | NFE2L2 (0.49) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL240090 | 0.72 | CA1 (0.60) | NFE2L2TRPA1CA12CA1CA2 |
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-1993013089-A1 | MACROCYCLIC POLYETHER CARBOXYLIC ACIDS | URBAN FRANK J (US) | 1993-07-08 | — | — | WO | disclosed |