Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | VCAM1 | P19320 | 4/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | FBP1 | P09467 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11513831 | 0.88 | CYP3A4 (0.37) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11514324 | 0.86 | CYP3A4 (0.46) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11512814 | 0.81 | ALDH1A1 (0.35) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11514125 | 0.81 | TDP1 (0.70) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11513107 | 0.80 | CCR6 (0.40) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11515596 | 0.73 | GPR35 (0.46) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11514574 | 0.73 | CYP3A4 (0.44) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11518692 | 0.71 | TDP1 (0.50) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL9524062 | 0.70 | TDP1 (0.63) | TDP1CYP3A4MAPK1TSHRMAPT | |
| SCHEMBL11649602 | 0.69 | TDP1 (0.68) | TDP1CYP3A4MAPK1TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4143073-A | REACTION OF SUBSTITUTED N-ALKOXY-2,6-DINITROANILINES WITH ALKYL OR ALKENYL HALIDE IN PRESENCE OF SODIUM HYDRIDE | ELI LILLY AND COMPANY (US) | 1979-03-06 | — | — | US | disclosed |
| US-4087460-A | HERBICIDES, PLANT GROWTH REGULATORS, CHEMICAL INTERMEDIATES | ELI LILLY AND COMPANY (US) | 1978-05-02 | — | — | US | disclosed |