Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 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 | |
|---|---|---|---|---|
| SCHEMBL1501395 | 1.00 | ALDH1A1 (0.43) | ALDH1A1AKR1C2AKR1C1CRHBPCRHR2 | |
| SCHEMBL29656816 | 0.80 | ACHE (0.36) | ALDH1A1AKR1C2AKR1C1CYP1A2TDP1 | |
| SCHEMBL28573118 | 0.80 | ALDH1A1 (0.40) | ALDH1A1MAOAKIF11MAPK1CYP1A2 | |
| SCHEMBL29429109 | 0.76 | ALDH1A1 (0.38) | ALDH1A1MAOAALOX5HSD17B10NOTUM | |
| Biphenyl SCHEMBL1881607 | 0.76 | ALDH1A1 (0.75) | ALDH1A1MAOAKIF11MAPK1CYP1A2 | |
| Biphenyl SCHEMBL17388552 | 0.76 | ALDH1A1 (0.75) | ALDH1A1MAOAKIF11MAPK1CYP1A2 | |
| SCHEMBL29139848 | 0.74 | ALDH1A1 (0.41) | ALDH1A1AKR1C2AKR1C1CRHBPCRHR2 | |
| Biphenyl SCHEMBL1149799 | 0.73 | ALDH1A1 (0.69) | ALDH1A1MAOAKIF11MAPK1CYP1A2 | |
| Biphenyl SCHEMBL28928156 | 0.73 | ALDH1A1 (0.69) | ALDH1A1MAOAKIF11MAPK1CYP1A2 | |
| Biphenyl SCHEMBL27570681 | 0.73 | ALDH1A1 (0.69) | ALDH1A1MAOAKIF11MAPK1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008077847-A1 | ANODIC ELECTROCHROMIC DYE, ELECTROCHROMIC FORMULATION THEREOF, AND METHOD OF PRODUCING AN ELECTROCHROMIC CELL | SIEMENS AKTIENGESELLSCHAFT (DE) | 2008-07-03 | — | — | WO | claimed |