Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TXNRD1 | Q16881 | 4/20 | 0.44 |
| ▸ | GSR | P00390 | 1/20 | 0.44 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 5/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.35 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8544140 | 0.99 | TXNRD1 (0.46) | TXNRD1GSRVCAM1THRBHCAR3 | |
| SCHEMBL8543433 | 0.96 | TXNRD1 (0.39) | TXNRD1GSRVCAM1THRBHCAR3 | |
| SCHEMBL8543074 | 0.91 | ALDH1A1 (0.38) | VCAM1THRBALDH1A1LMNAPOLB | |
| SCHEMBL8539439 | 0.88 | TXNRD1 (0.44) | TXNRD1GSRVCAM1THRBHCAR3 | |
| SCHEMBL8537979 | 0.87 | ALDH1A1 (0.40) | VCAM1THRBALDH1A1LMNAPOLB | |
| SCHEMBL8542821 | 0.87 | TXNRD1 (0.46) | TXNRD1GSRVCAM1THRBESR1 | |
| SCHEMBL8537184 | 0.84 | TXNRD1 (0.39) | TXNRD1GSRVCAM1THRBHCAR3 | |
| SCHEMBL6935243 | 0.83 | SLC9A1 (0.49) | — | |
| SCHEMBL7073129 | 0.82 | SLC9A1 (0.48) | — | |
| SCHEMBL8537834 | 0.80 | SLC9A1 (0.43) | THRB |
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 |