Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 5/20 | 0.76 |
| ▸ | HTR1B | P28222 | 4/20 | 0.76 |
| ▸ | CFB | P00751 | 5/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 8/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 7/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 7/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.51 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10979251 | 0.86 | HTR1D (0.71) | HTR1DHTR1BCFBADRA2CADRA1A | |
| Hydrochloric Acid SCHEMBL10973842 | 0.85 | HTR1D (0.69) | HTR1DHTR1BCFBADRA2CADRA1A | |
| SCHEMBL24658874 | 0.83 | ADRA2A (0.71) | HTR1DHTR1BCFBADRA2CADRA1A | |
| SCHEMBL4760243 | 0.82 | HTR1D (1.00) | HTR1DHTR1BCFBADRA2CADRA1A | |
| Hydrochloric Acid SCHEMBL29384552 | 0.81 | HTR1D (0.97) | HTR1DHTR1BCFBADRA2CADRA1A | |
| SCHEMBL6054534 | 0.77 | HTR1D (0.58) | HTR1DHTR1BCFBADRA2CADRA1A | |
| SCHEMBL14976356 | 0.74 | CFB (0.67) | HTR1DHTR1BCFBADRA2CADRA1A | |
| SCHEMBL8693621 | 0.74 | CFB (0.57) | HTR1DHTR1BCFBADRA2CADRA1A | |
| SCHEMBL6054523 | 0.74 | ADRA2A (0.63) | HTR1DHTR1BCFBADRA2CADRA1A | |
| SCHEMBL6585037 | 0.74 | HTR1D (0.55) | HTR1DHTR1BCFBADRA2CADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016105449-A1 | COMPOUNDS FOR USE AS PAIN THERAPEUTICS | LEDERMAN SETH (US) | 2016-06-30 | — | — | WO | disclosed |
| US-4389403-A | HYPOTENSIVE AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 1983-06-21 | — | — | US | disclosed |