Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | SGK1 | O00141 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NAT1 | P18440 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9231998 | 0.74 | PGR (0.52) | ALDH1A1LMNASMN1; SMN2CA1CA2 | |
| SCHEMBL13485838 | 0.70 | CA2 (0.45) | CCR2ALDH1A1NLRP3POLBCA1 | |
| SCHEMBL29813806 | 0.70 | CCR2 (0.43) | CCR2ALDH1A1LMNANLRP3SMN1; SMN2 | |
| SCHEMBL8227599 | 0.70 | CCR2 (0.46) | CCR2ALDH1A1LMNANLRP3SMN1; SMN2 | |
| SCHEMBL29813636 | 0.70 | CCR2 (0.46) | CCR2HSD17B10ALDH1A1NLRP3POLB | |
| SCHEMBL8062374 | 0.69 | NLRP3 (0.50) | CCR2ALDH1A1NLRP3SMN1; SMN2POLB | |
| SCHEMBL20377311 | 0.69 | HCAR2 (0.41) | CCR2ALDH1A1NLRP3POLBKAT6A | |
| SCHEMBL27575208 | 0.69 | CA2 (0.54) | CA1CA2CA9PGR | |
| SCHEMBL329418 | 0.68 | — | — | |
| SCHEMBL4565158 | 0.67 | PGR (0.50) | HSD17B10LMNAHPGDSMN1; SMN2POLB |
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-6331637-B1 | N-Alkyl, N-Alkenyl, N-Alkynyl, N-Aryl and N-fused bicyclo or tricyclo thienyl-, furyl-,and Pyrrolyl-sulfonamides and derivatives thereof that modulate the activity of endothelin | TEXAS BIOTECHNOLOGY CORPORATION | 2001-12-18 | — | — | US | disclosed |