Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.57 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.55 |
| ▸ | MGLL | Q99685 | 1/20 | 0.55 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | IDH1 | O75874 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1928912 | 0.88 | TSHR (0.67) | TSHRCYP4A11CYP4F2MGLLLOXL2 | |
| SCHEMBL70185 | 0.84 | CYP4A11 (0.75) | TSHRCYP4A11CYP4F2MGLLLOXL2 | |
| SCHEMBL8733948 | 0.82 | MEN1 (0.52) | RAB9AMAPTNPC1HSD17B10CASP3 | |
| SCHEMBL8162236 | 0.82 | ALDH1A1 (0.60) | TSHRCYP4A11CYP4F2MGLLLOXL2 | |
| SCHEMBL7777934 | 0.81 | CA1 (0.60) | TSHRCYP4A11CYP4F2MGLLLOXL2 | |
| SCHEMBL7776449 | 0.81 | MAPT (0.64) | TSHRCYP4A11CYP4F2MGLLLOXL2 | |
| SCHEMBL1980745 | 0.81 | RAB9A (0.67) | TSHRCYP4A11CYP4F2MGLLLOXL2 | |
| SCHEMBL9806373 | 0.80 | HDAC1 (0.52) | CA1CA2RAB9AMAPTNPC1 | |
| Methyl Benzoate SCHEMBL28249321 | 0.80 | TSHR (0.95) | TSHRCA1CA2RAB9AMAPT | |
| SCHEMBL2404460 | 0.80 | CYP4A11 (0.73) | TSHRCYP4A11CYP4F2MGLLLOXL2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0407955-A1 | New hetrazepines acting as PAF antagonists, process for their production and their use as drugs | BOEHRINGER INGELHEIM KG (DE) | 1991-01-16 | — | — | EP | disclosed |