Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.52 |
| ▸ | TACR2 | P21452 | 2/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | SHBG | P04278 | 1/20 | 0.52 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.52 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | TST | Q16762 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8087309 | 0.91 | HTR2A (0.50) | KEAP1CYP3A4SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL29000463 | 0.87 | ESR1 (0.69) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL11265413 | 0.86 | ESR1 (0.49) | KEAP1ESR1CYP3A4ADRA2AADORA3 | |
| SCHEMBL8093734 | 0.85 | HTR2A (0.55) | LMNALIPGHTR2AHTT | |
| SCHEMBL6547306 | 0.85 | HTR2A (0.59) | CYP3A4TP53LMNALIPGHTR2A | |
| SCHEMBL8086301 | 0.85 | LIPG (0.53) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| Phenol SCHEMBL28085362 | 0.85 | ESR1 (0.51) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL11108899 | 0.84 | ESR1 (0.50) | KEAP1ESR1CYP3A4ADRA2AADORA3 | |
| SCHEMBL8099212 | 0.84 | HTR2A (0.44) | CYP3A4SLC6A2SLC6A4SLC6A3LMNA | |
| SCHEMBL6546225 | 0.84 | HTR2A (0.44) | CYP3A4SLC6A2SLC6A4SLC6A3ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0070087-B1 | CONNECTOR MEMBER ADAPTED FOR ULTRAVIOLET ANTIMICROBIAL IRRADIATION | BAXTER TRAVENOL LABORATORIES, INC. (US) | 1986-01-29 | — | — | EP | claimed |
| US-5132364-A | Poly/p-hydroxystyrene/ or p-hydroxystyrene-styrene copolymer as stabilizer, thermoplastic molding composition | GENERAL ELECTRIC COMPANY (US) | 1992-07-21 | — | — | US | disclosed |