Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | ITGAL | P20701 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PKLR | P30613 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL517094 | 0.79 | GRM5 (0.51) | CYP1A2CYP2C9ITGB2ICAM1ITGAL | |
| SCHEMBL18027237 | 0.79 | CYP1A2 (0.36) | CYP1A2CYP2C9ITGB2ICAM1ITGAL | |
| SCHEMBL29933984 | 0.79 | GRM5 (0.51) | CYP1A2CYP2C9ITGB2ICAM1ITGAL | |
| SCHEMBL10222510 | 0.75 | GRM5 (0.33) | CYP1A2CYP2C9ITGB2ICAM1ITGAL | |
| SCHEMBL5366473 | 0.75 | GRM5 (0.38) | CYP1A2CYP2C9ITGB2ICAM1ITGAL | |
| SCHEMBL15221563 | 0.75 | KDM4E (0.37) | CYP1A2CYP2C9CYP11B2GRM5CYP11B1 | |
| SCHEMBL10305614 | 0.75 | GRM5 (0.52) | CYP1A2CYP2C9CYP11B2GRM5CYP11B1 | |
| SCHEMBL19859246 | 0.73 | CYP11B2 (0.47) | CYP11B2GRM5NOTUMLMNA | |
| SCHEMBL16907815 | 0.72 | KMT2A (0.42) | CYP11B2GRM5NOTUM | |
| SCHEMBL12076615 | 0.72 | CYP11B2 (0.62) | CYP11B2GRM5NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020160174-A1 | USES OF COMPOUNDS HAVING ANTI-HSV-1 ACTIVITY | UNIVERSITA DEGLI STUDI DI PADOVA (IT) | 2020-08-06 | — | — | WO | disclosed |
| WO-2020160175-A1 | QUINDOLINE COMPOUNDS AND USES THEREOF | ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) | 2020-08-06 | — | — | WO | disclosed |