Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 7/20 | 0.48 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | AGXT | P21549 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19785488 | 0.81 | APP (0.50) | APPPDE2ACNR1CNR2MAOB | |
| SCHEMBL30296090 | 0.81 | APP (0.50) | APPPDE2ACNR1CNR2MAOB | |
| SCHEMBL22321646 | 0.77 | APP (0.57) | APPPDE2AMAOBNPC1RAB9A | |
| SCHEMBL22321626 | 0.76 | APP (0.54) | APPPDE2AMAOBNPC1RAB9A | |
| SCHEMBL19785487 | 0.76 | CSF1R (0.50) | APPCNR1CNR2MAOBNPC1 | |
| SCHEMBL29361274 | 0.76 | CSF1R (0.50) | APPCNR1CNR2MAOBNPC1 | |
| SCHEMBL14478707 | 0.76 | APP (0.54) | APPPDE2ACNR1CNR2MAOB | |
| SCHEMBL12284212 | 0.74 | APP (0.53) | APPPDE2ACNR1CNR2MAOB | |
| SCHEMBL22337256 | 0.74 | APP (0.49) | APPPDE2AMAOBNPC1RAB9A | |
| SCHEMBL24344230 | 0.74 | APP (0.56) | APPCNR1CNR2MAOBNPC1 |
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-2018013597-A1 | 2,5-DISUBSTITUTED 3-METHYL PYRAZINES AND 2,5,6-TRISUBSTITUTED 3-METHYL PYRAZINES AS ALLOSTERIC SHP2 INHIBITORS | Revolution Medicines, Inc. (US) | 2018-01-18 | — | — | WO | disclosed |