Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 6/20 | 0.54 |
| ▸ | CASR | P41180 | 5/20 | 0.54 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.45 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.45 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10967219 | 0.87 | ADRB2 (0.53) | ADRB2CASRADRB3CYP1A2CYP2D6 | |
| SCHEMBL9329796 | 0.80 | ADRB2 (0.64) | ADRB2ADRB3CYP1A2CYP2D6TP53 | |
| SCHEMBL144562 | 0.80 | KMT2A (0.70) | KDM4EALDH1A1KMT2ALMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9506677 | 0.80 | KMT2A (0.50) | ADRB2ADRB3CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL11225584 | 0.79 | ADRB2 (0.63) | ADRB2ADRB3CYP1A2CYP2D6TP53 | |
| SCHEMBL2554676 | 0.79 | NPSR1 (0.56) | ADRB2KDM4EALDH1A1KMT2AABCB1 | |
| SCHEMBL10667000 | 0.79 | KDM4E (0.52) | ADRB2ADRB3CYP1A2CYP2D6TP53 | |
| SCHEMBL10967217 | 0.77 | ADRB2 (0.54) | ADRB2CASRADRB3CYP1A2CYP2D6 | |
| SCHEMBL11849265 | 0.77 | KDM4E (0.58) | ADRB2ADRB3CYP1A2CYP2D6TP53 | |
| SCHEMBL11954116 | 0.76 | HTR1A (0.64) | ADRB2CASRADRB3CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007130627-A2 | IL-33 IN THE TREATMENT AND DIAGNOSIS OF DISEASES AND DISORDERS | THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) | 2007-11-15 | — | — | WO | disclosed |