Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | RORC | P51449 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 2/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 6/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.45 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11329635 | 0.86 | TSHR (0.54) | TSHRRORCCES2CES1MEN1 | |
| SCHEMBL7115339 | 0.83 | KMT2A (0.57) | MEN1KMT2AMAPTPLA2G1BATG4B | |
| SCHEMBL28011591 | 0.81 | TSHR (0.59) | TSHRCES2CES1MEN1KMT2A | |
| SCHEMBL206197 | 0.81 | TSHR (0.57) | TSHRCES2CES1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10824597 | 0.79 | TSHR (0.55) | TSHRCES2CES1MEN1KMT2A | |
| SCHEMBL27635677 | 0.79 | TP53 (0.69) | TSHRCES2CES1MEN1KMT2A | |
| SCHEMBL4831177 | 0.78 | TNF (0.64) | RORCMEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL9074113 | 0.78 | RORC (0.53) | TSHRRORCMEN1KMT2AMAPT | |
| Acetic Acid SCHEMBL11593607 | 0.78 | TSHR (0.62) | TSHRCES2CES1MEN1KMT2A | |
| Benzoic Acid SCHEMBL27636821 | 0.77 | TSHR (0.67) | TSHRCES2CES1MEN1KMT2A |
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-4306103-A | Process for the manufacture of 1,3,5-trichlorobenzene | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-12-15 | — | — | US | disclosed |