Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6175951 | 0.84 | CA1 (0.56) | ALDH1A1KDM4EKEAP1NFE2L2HCAR2 | |
| SCHEMBL6175944 | 0.84 | CA1 (0.56) | ALDH1A1KDM4EKEAP1NFE2L2HCAR2 | |
| SCHEMBL28570960 | 0.83 | GPR52 (0.47) | SMN1; SMN2NOS3NOS1NOS2KMT2A | |
| SCHEMBL31177346 | 0.83 | ALDH1A1 (0.45) | SMN1; SMN2POLBRAB9AALDH1A1KDM4E | |
| SCHEMBL6176085 | 0.83 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL17592719 | 0.83 | KDM4E (0.43) | ALDH1A1KDM4EKEAP1NFE2L2HCAR2 | |
| SCHEMBL17592772 | 0.83 | KDM4E (0.43) | ALDH1A1KDM4EKEAP1NFE2L2HCAR2 | |
| SCHEMBL6176091 | 0.83 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL17592718 | 0.83 | KDM4E (0.43) | ALDH1A1KDM4EKEAP1NFE2L2HCAR2 | |
| SCHEMBL8262659 | 0.82 | MAOB (0.50) | POLBRAB9AALDH1A1KEAP1NFE2L2 |
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-5675034-A | Process for preparing 2-(p-fluorophenyl)-2 methyl-propionic acid and 3-(p-fluorophenyl)-2-methylpropionic acid derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-10-07 | — | — | US | disclosed |