Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA4 | P22748 | 1/20 | 0.55 |
| ▸ | CA5A | P35218 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 3/20 | 0.32 |
| ▸ | PGK2 | P07205 | 3/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2171752 | 0.85 | CA2 (0.71) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL22999982 | 0.77 | CA2 (0.60) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL4953765 | 0.77 | CA2 (0.60) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL915277 | 0.74 | CA2 (0.57) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL12313514 | 0.72 | CA2 (0.55) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL1828823 | 0.72 | CA2 (0.55) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL3247756 | 0.72 | CA2 (0.55) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL1567573 | 0.72 | CA2 (0.55) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL232482 | 0.72 | CA2 (0.55) | CA2CA4CA5ATSHRLMNA | |
| SCHEMBL13713762 | 0.72 | CA2 (0.55) | CA2CA4CA5ATSHRLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6372727-B1 | ADMINISTERING IRON PORPHYRIN TO TREAT AMYOTROPHIC LATERAL SCLEROSIS; TREATING OXIDATIVE INJURY RELATED TO PEROXYNITRITE | UAB RESEARCH FOUNDATION | 2002-04-16 | — | — | US | disclosed |
| WO-2001026655-A1 | METALLOPORPHYRIN TREATMENT OF NEUROLOGIC DISEASE | UAB RESEARCH FOUNDATION (US) | 2001-04-19 | — | — | WO | disclosed |