Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | PNMT | P11086 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12043383 | 0.74 | ALDH1A1 (0.34) | ACHEHTR5ACYP1A2ADRA2AADRA2B | |
| SCHEMBL1029989 | 0.69 | ADRA2A (0.37) | CYP1A2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL18031553 | 0.68 | TRPA1 (0.49) | LMNACYP3A4TSHRBLMNPSR1 | |
| SCHEMBL28154837 | 0.67 | ACHE (0.48) | ACHECYP2D6CYP1A2ADRA2AADRA2B | |
| SCHEMBL5534457 | 0.67 | ACHE (0.41) | ACHEHTR5AHTR1AHTR1DHTR2A | |
| SCHEMBL846102 | 0.67 | HTR2A (0.38) | HTR2AHTR2C | |
| SCHEMBL2063701 | 0.65 | ACHE (0.39) | ACHEHTR5AHTR1AHTR1DHTR2A | |
| SCHEMBL11336934 | 0.65 | ACHE (0.36) | ACHEHTR5ACYP2D6CYP1A2PNMT | |
| SCHEMBL890970 | 0.63 | HSD17B10 (0.42) | CYP1A2CYP2A6CYP3A4TSHRALDH1A1 | |
| SCHEMBL4821733 | 0.62 | CYP1A2 (0.35) | ACHECYP1A2CYP2A6LMNATSHR |
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-2015172238-A1 | LIQUID FERTILIZER COMPOSITIONS COMPRISING AN AUXIN. CORRESPONDING PREPARATION METHODS AND USES | AGRO-100 LTÉE (CA) | 2015-11-19 | — | — | WO | disclosed |