Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TXNRD1 | Q16881 | 3/20 | 0.40 |
| ▸ | GSR | P00390 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 6/20 | 0.36 |
| ▸ | CA1 | P00915 | 6/20 | 0.36 |
| ▸ | CA2 | P00918 | 6/20 | 0.36 |
| ▸ | CA6 | P23280 | 6/20 | 0.36 |
| ▸ | CA5A | P35218 | 6/20 | 0.36 |
| ▸ | CA7 | P43166 | 6/20 | 0.36 |
| ▸ | CA9 | Q16790 | 6/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 6/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 6/20 | 0.36 |
| ▸ | CA4 | P22748 | 5/20 | 0.36 |
| ▸ | CA3 | P07451 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8542948 | 0.99 | TXNRD1 (0.39) | TXNRD1GSRCA12CA1CA2 | |
| SCHEMBL8537187 | 0.99 | TXNRD1 (0.39) | TXNRD1GSRCA12CA1CA2 | |
| SCHEMBL8543278 | 0.98 | TXNRD1 (0.38) | TXNRD1GSRCA12CA1CA2 | |
| SCHEMBL8542635 | 0.95 | TXNRD1 (0.36) | TXNRD1GSRALDH1A1MCOLN3THRB | |
| SCHEMBL8542221 | 0.85 | TXNRD1 (0.41) | TXNRD1GSRCA12CA1CA2 | |
| SCHEMBL8540504 | 0.85 | ACHE (0.33) | KMT2AALDH1A1MCOLN3THRBMAPT | |
| SCHEMBL27355048 | 0.85 | TXNRD1 (0.36) | TXNRD1GSRCA12CA1CA2 | |
| SCHEMBL8538600 | 0.84 | TXNRD1 (0.41) | TXNRD1GSRCA12CA1CA2 | |
| SCHEMBL8538162 | 0.84 | TXNRD1 (0.41) | TXNRD1GSRCA12CA1CA2 | |
| SCHEMBL27528085 | 0.84 | TXNRD1 (0.35) | TXNRD1GSRCA12CA1CA2 |
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-5744641-A | Sulfonyl- or sulfinylbenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-04-28 | — | — | US | disclosed |