Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.49 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP3 | P08254 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9073629 | 0.85 | KDM4E (0.53) | CA2PLAAT5PLAAT4SMN1; SMN2KDM4E | |
| SCHEMBL10395199 | 0.82 | SMN1; SMN2 (0.64) | SMN1; SMN2ADRA1AALDH1A1TAAR1LMNA | |
| SCHEMBL157742 | 0.82 | KEAP1 (0.59) | KEAP1CA12CA2CA9EPHX1 | |
| SCHEMBL27759805 | 0.80 | KEAP1 (0.57) | KEAP1CA12CA2CA9EPHX1 | |
| Hydrochloric Acid SCHEMBL10493762 | 0.80 | MAPT (0.59) | KEAP1CA12CA2CA9EPHX1 | |
| SCHEMBL4622917 | 0.79 | THRB (0.48) | KEAP1EPHX1FFAR1ALDH1A1GAA | |
| SCHEMBL27804343 | 0.79 | CA12 (0.55) | KEAP1CA12CA2CA9EPHX1 | |
| SCHEMBL158734 | 0.74 | SIGMAR1 (0.67) | KEAP1SMN1; SMN2ADRA1AHDAC3MAPK1 | |
| SCHEMBL425836 | 0.74 | ALDH1A1 (0.53) | CA12CA2CA9EPHX1PLAAT5 | |
| SCHEMBL8652161 | 0.74 | ALDH1A1 (0.50) | KEAP1CA12CA2CA9EPHX1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5480871-A | TREATMENT OF BENIGN PROSTATIC HYPERPLASIA | CHIRON CORPORATION (US) | 1996-01-02 | — | — | US | disclosed |
| WO-1995027729-A1 | OPIATE RECEPTOR LIGANDS | CHIRON CORPORATION (US) | 1995-10-19 | — | — | WO | disclosed |
| WO-1995004072-A1 | PEPTOID ALPHA-1 ADRENERGIC RECEPTOR LIGANDS | CHIRON CORPORATION (US) | 1995-02-09 | — | — | WO | disclosed |