Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3784479 | 0.82 | KIF11 (0.50) | MAOAKIF11TSHRMAPK1NPC1 | |
| SCHEMBL1041026 | 0.82 | ESR2 (0.52) | KIF11KMOCYP11B2 | |
| SCHEMBL439937 | 0.79 | TSHR (0.56) | KIF11TSHRMAPK1MAPTSMN1; SMN2 | |
| SCHEMBL29944898 | 0.79 | TSHR (0.56) | KIF11TSHRMAPK1MAPTSMN1; SMN2 | |
| SCHEMBL3717047 | 0.79 | TAAR1 (0.47) | KMOSYK | |
| SCHEMBL3792886 | 0.79 | MAOA (0.50) | MAOAKIF11TSHRMAPK1MAP4K4 | |
| SCHEMBL30469355 | 0.77 | AHR (0.61) | MAOATSHRMAPK1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL14935577 | 0.77 | TSHR (0.54) | KIF11TSHRMAPK1MAPTSMN1; SMN2 | |
| SCHEMBL20557309 | 0.77 | AHR (0.61) | MAOATSHRMAPK1NPC1RAB9A | |
| SCHEMBL16545009 | 0.77 | MAOA (0.52) | MAOATSHRMAPK1MAP4K4CA12 |
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-0029123-B1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED ANILINES, AND SUBSTITUTED ANILINES | BASF Aktiengesellschaft (DE) | 1983-06-08 | — | — | EP | disclosed |