Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KMO | O15229 | 2/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.36 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
| ▸ | ITGAL | P20701 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9767946 | 0.76 | LMNA (0.49) | CYP3A4TSHRHSD17B10ALDH1A1KMT2A | |
| SCHEMBL34471499 | 0.75 | CYP3A4 (0.46) | CYP3A4TSHRITGB2ICAM1ITGAL | |
| SCHEMBL27388363 | 0.71 | CYP3A4 (0.42) | CYP3A4TSHRCA1CA2HSD17B10 | |
| SCHEMBL16291006 | 0.71 | EPHX2 (0.47) | CYP3A4TSHRCA1CA2ALDH1A1 | |
| SCHEMBL9767957 | 0.71 | GAA (0.37) | CYP3A4TSHRKMOCA1CA2 | |
| SCHEMBL9767939 | 0.70 | CYP3A4 (0.41) | CYP3A4TSHRCA1CA2HSD17B10 | |
| SCHEMBL9656928 | 0.70 | GRIK1 (0.47) | CYP3A4TSHRKMOCA1CA2 | |
| SCHEMBL9656936 | 0.70 | GRIK1 (0.47) | CYP3A4TSHRKMOCA1CA2 | |
| SCHEMBL9767917 | 0.70 | GAA (0.39) | CYP3A4TSHRITGB2ICAM1ITGAL | |
| SCHEMBL7767699 | 0.70 | CYP3A4 (0.41) | CYP3A4TSHRALDH1A1HPGDKMT2A |
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-5013354-A | Tetrahydrophthalimido group, herbicides | BASF AKTIENGESELLSCHAFT (DE) | 1991-05-07 | — | — | US | disclosed |