Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 7/20 | 0.78 |
| ▸ | P2RY2 | P41231 | 3/20 | 0.78 |
| ▸ | SRC | P12931 | 2/20 | 0.78 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.78 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.78 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.78 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.78 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.78 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.78 |
| ▸ | TRPM2 | O94759 | 2/20 | 0.75 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.75 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.75 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.75 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.75 |
| ▸ | LDHA | P00338 | 1/20 | 0.75 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.75 |
| ▸ | FBP1 | P09467 | 1/20 | 0.75 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.75 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.75 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.75 |
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 | |
|---|---|---|---|---|
| SCHEMBL30381845 | 1.00 | P2RY1 (0.78) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL31207056 | 0.92 | P2RY1 (0.79) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL4370423 | 0.91 | P2RY1 (0.81) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL1332848 | 0.91 | P2RY1 (0.81) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL30252355 | 0.90 | P2RY1 (0.71) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL11909558 | 0.90 | P2RY1 (0.71) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL31212995 | 0.90 | P2RY1 (0.71) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL31538691 | 0.90 | P2RY1 (0.71) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL11909560 | 0.90 | P2RY1 (0.71) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 | |
| SCHEMBL28319431 | 0.90 | P2RY1 (0.82) | P2RY1P2RY2SRCSMN1; SMN2P2RX1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9673030-B2 | Computer readable storage mediums, methods and systems for normalizing chemical profiles in biological or medical samples detected by mass spectrometry | EMORY UNIVERSITY (US) | 2017-06-06 | — | — | US | disclosed |
| US-20110282587-A1 | COMPUTER READABLE STORAGE MEDIUMS, METHODS AND SYSTEMS FOR NORMALIZING CHEMICAL PROFILES IN BIOLOGICAL OR MEDICAL SAMPLES DETECTED BY MASS SPECTROMETRY | EMORY UNIVERSITY (US) | 2011-11-17 | — | — | US | disclosed |