Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 8/20 | 0.46 |
| ▸ | NR2E1 | Q9Y466 | 6/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.42 |
| ▸ | HTR2B | P41595 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR6 | P50406 | 3/20 | 0.42 |
| ▸ | SCN1A | P35498 | 2/20 | 0.42 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28665971 | 0.77 | CYP1A2 (0.40) | CYP2D6CYP1A2SLC6A4ADRB2ADRB1 | |
| SCHEMBL5031818 | 0.73 | NR2E1 (0.64) | HTR1BNR2E1HTR1DCYP2D6CYP1A2 | |
| SCHEMBL29829725 | 0.73 | NR2E1 (0.64) | HTR1BNR2E1HTR1DCYP2D6CYP1A2 | |
| SCHEMBL8344968 | 0.70 | HTR1B (0.64) | HTR1BNR2E1HTR1DSLC6A4ALDH1A1 | |
| SCHEMBL28648150 | 0.70 | CYP1A2 (0.47) | CYP1A2HTR2BHTR2AHTR2CSMN1; SMN2 | |
| SCHEMBL4982131 | 0.70 | CYP1A2 (0.56) | HTR1BNR2E1HTR1DCYP2D6CYP1A2 | |
| SCHEMBL6831487 | 0.70 | HTR1B (0.50) | HTR1BNR2E1HTR1DCYP2D6CYP1A2 | |
| SCHEMBL27265895 | 0.69 | HTR1B (0.62) | HTR1BNR2E1HTR1DSLC6A4ALDH1A1 | |
| SCHEMBL17286559 | 0.69 | HTR1B (0.65) | HTR1BNR2E1HTR1DSLC6A4HRH1 | |
| SCHEMBL9477167 | 0.68 | MCHR1 (0.54) | HTR1BNR2E1HTR1DCYP2D6CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113527561-B | Molybdenum-based catalyst for catalyzing butadiene to polymerize with high 1, 2-selectivity and application method thereof | 青岛科技大学 | 2022-07-08 | — | — | CN | disclosed |
| CN-113527561-A | Molybdenum-based catalyst for catalyzing butadiene to polymerize with high 1, 2-selectivity and application method thereof | 青岛科技大学 | 2021-10-22 | — | — | CN | disclosed |