Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28172457 | 0.88 | ADRB1 (0.48) | NISCHHTR7CA12CA1CA2 | |
| SCHEMBL8347291 | 0.78 | PDE4A (0.46) | THRBTSHRHSD17B10CD274 | |
| SCHEMBL1515024 | 0.77 | CA1 (0.58) | NISCHTHRBRECQLCA12CA1 | |
| SCHEMBL8960071 | 0.74 | ADRA2A (0.56) | NISCHHTR7ADRA2AADRA2BCA12 | |
| SCHEMBL25406296 | 0.74 | CD274 (0.61) | HTR2AHTR2CHTR2BCD274KCNH2 | |
| SCHEMBL8635851 | 0.74 | HTR2A (0.42) | HTR7HTR3AHTR2AHTR2CHTR2B | |
| SCHEMBL8638141 | 0.74 | SIGMAR1 (0.52) | HTR7ADRA2AADRA2BADRA2CLMNA | |
| SCHEMBL8640742 | 0.73 | PTGS2 (0.44) | HTR2AHTR2CHTR2BCD274 | |
| SCHEMBL1515037 | 0.73 | CA1 (0.52) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL23273586 | 0.73 | CA12 (0.52) | CA12CA1CA2CA7CA9 |
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-5824690-A | TREATING ASTHMA, COUGH | HOECHST MARION ROUSSEL INC. (US) | 1998-10-20 | — | — | US | disclosed |