Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.37 |
| ▸ | TOP2A | P11388 | 1/20 | 0.37 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12628244 | 0.80 | ALDH1A1 (0.46) | CYP1A2ALDH1A1GAATSHRKDM4E | |
| SCHEMBL30615630 | 0.75 | AURKA (0.56) | TOP2ATOP2BTSHR | |
| SCHEMBL1104835 | 0.74 | MAPK1 (0.63) | HTR3ACYP11B1CYP11B2CHRNB2CHRNA4 | |
| SCHEMBL3293262 | 0.73 | NPC1 (0.35) | HTR3AMGAMALDH1A1PDGFRBPDGFRA | |
| SCHEMBL12792169 | 0.73 | CYP11B1 (0.46) | HTR3ACYP11B1CYP11B2CHRNB2CHRNA4 | |
| SCHEMBL30615331 | 0.72 | DAO (0.47) | HTR3ACYP11B1CYP11B2CHRNB2CHRNA4 | |
| SCHEMBL21463917 | 0.72 | DAO (0.47) | HTR3ACYP11B1CYP11B2CHRNB2CHRNA4 | |
| SCHEMBL15073544 | 0.72 | CYP11B1 (0.44) | HTR3ACYP11B1CYP11B2CHRNB2CHRNA4 | |
| SCHEMBL28752516 | 0.71 | HSP90AA1 (0.56) | HTR3ACYP11B1CYP11B2CHRNB2CHRNA4 | |
| SCHEMBL14924605 | 0.71 | CYP11B1 (0.43) | HTR3ACYP11B1CYP11B2CHRNB2CHRNA4 |
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-7652006-B2 | For therapy and prophylaxis of neuronal loss associated with stroke, global and focal ischemia, CNS trauma, hypoglycemia and surgery, for ameliorating neurodegenerative diseases | EURO-CELTIQUE S.A. (LU) | 2010-01-26 | — | — | US | disclosed |