Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB2 | P05107 | 1/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.41 |
| ▸ | ITGAL | P20701 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 2/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.32 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL768353 | 1.00 | ITGB2 (0.41) | ITGB2ICAM1ITGALDPP4LMNA | |
| SCHEMBL29961242 | 0.89 | ITGB2 (0.39) | ITGB2ICAM1ITGALDPP4LMNA | |
| SCHEMBL97553 | 0.81 | ITGB2 (0.41) | ITGB2ICAM1ITGALDPP4LMNA | |
| SCHEMBL4524534 | 0.81 | IMPDH2 (0.41) | ITGB2ICAM1ITGALHTR2AABCG2 | |
| SCHEMBL26769086 | 0.77 | ITGB2 (0.38) | ITGB2ICAM1ITGALLMNACRHBP | |
| SCHEMBL23704789 | 0.76 | ADRA2A (0.47) | LMNAHTTMAP3K14 | |
| SCHEMBL9432676 | 0.76 | ADRA2A (0.38) | LMNASMN1; SMN2TRPV1 | |
| SCHEMBL2776662 | 0.76 | HSD17B2 (0.39) | LMNAHTTMAP3K14TRPV1LRRK2 | |
| SCHEMBL7128481 | 0.76 | CYP19A1 (0.44) | ITGB2ICAM1ITGAL | |
| SCHEMBL8083561 | 0.75 | ITGB2 (0.46) | ITGB2ICAM1ITGALLMNACRHBP |
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-2022204150-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS | BLUE OAK PHARMACEUTICALS, INC. (US) | 2022-09-29 | — | — | WO | disclosed |