Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.55 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.55 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8372186 | 1.00 | AKR1C4 (0.55) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL4398296 | 0.81 | AKR1C4 (0.56) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL29683626 | 0.81 | AKR1C4 (0.56) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL8055907 | 0.77 | AKR1C3 (0.51) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL17627594 | 0.77 | AKR1C4 (0.60) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL11117678 | 0.73 | HSPD1 (0.48) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL11119474 | 0.73 | AKR1C4 (0.47) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL7182510 | 0.73 | AKR1C4 (0.72) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL8055911 | 0.72 | AKR1C4 (0.55) | AKR1C4AKR1C3AKR1C2AKR1C1AR | |
| SCHEMBL31668173 | 0.72 | AKR1C4 (0.55) | AKR1C4AKR1C3AKR1C2AKR1C1AR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0669940-B1 | SPECIFICALLY CROSSLINKED HEMOGLOBIN WITH FREE FUNCTIONALITY | UNIV TORONTO (CA) | 1999-02-10 | — | — | EP | disclosed |
| US-5399671-A | Specifically crosslinked hemoglobin with free functionality | UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION, THE (CA) | 1995-03-21 | — | — | US | disclosed |