Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.30 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10644838 | 0.79 | CYP4F2 (0.59) | MAPK1TDP1CYP3A4TRPA1CYP4F2 | |
| SCHEMBL7931311 | 0.72 | MAPK1 (0.49) | MAPK1TDP1CYP3A4TRPA1TSHR | |
| SCHEMBL7826908 | 0.71 | CYP4F2 (0.42) | MAPK1TDP1CYP3A4TRPA1CYP4F2 | |
| SCHEMBL9586345 | 0.71 | CYP4F2 (0.44) | MAPK1TDP1CYP3A4TRPA1CYP4F2 | |
| SCHEMBL281996 | 0.71 | MAPK1 (0.63) | MAPK1TDP1CYP3A4TRPA1TSHR | |
| SCHEMBL9859196 | 0.70 | MAPK1 (0.50) | MAPK1TDP1CYP3A4TRPA1CYP4F2 | |
| SCHEMBL8929753 | 0.70 | MAPK1 (0.50) | MAPK1TDP1CYP3A4TRPA1CYP4F2 | |
| SCHEMBL7247754 | 0.70 | MAPK1 (0.46) | MAPK1TDP1CYP3A4TRPA1TSHR | |
| SCHEMBL1428432 | 0.69 | TDP1 (0.56) | MAPK1TDP1CYP3A4TRPA1TSHR | |
| SCHEMBL30987212 | 0.68 | CYP4F2 (0.41) | MAPK1TDP1CYP3A4TRPA1CYP4F2 |
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-6602825-B1 | Cyclization of an isocyanate with a thiourea and carbonic acid | BASF AKTIENGESELLSCHAFT (DE) | 2003-08-05 | — | — | US | disclosed |