Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENTPD1 | P49961 | 3/20 | 0.68 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.59 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.58 |
| ▸ | SRC | P12931 | 1/20 | 0.58 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.58 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.58 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.58 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.58 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL6827710 | 0.88 | ENTPD1 (0.70) | ENTPD1TRPM2P2RY1SRCP2RY2 | |
| SCHEMBL18858917 | 0.86 | ENTPD1 (0.77) | ENTPD1TRPM2P2RY1SRCP2RY2 | |
| SCHEMBL21283084 | 0.86 | ENTPD1 (0.77) | ENTPD1TRPM2P2RY1SRCP2RY2 | |
| SCHEMBL18852609 | 0.86 | ENTPD1 (0.77) | ENTPD1TRPM2P2RY1SRCP2RY2 | |
| SCHEMBL16805436 | 0.86 | ENTPD1 (0.77) | ENTPD1TRPM2P2RY1SRCP2RY2 | |
| SCHEMBL3021626 | 0.85 | ENTPD1 (0.67) | ENTPD1TRPM2P2RY1 | |
| SCHEMBL636535 | 0.85 | ENTPD1 (0.75) | ENTPD1TRPM2P2RY1 | |
| SCHEMBL636536 | 0.85 | ENTPD1 (0.75) | ENTPD1TRPM2P2RY1 | |
| SCHEMBL6827694 | 0.85 | ENTPD1 (0.68) | ENTPD1TRPM2P2RY1SRCP2RY2 | |
| SCHEMBL29398104 | 0.84 | ENTPD1 (0.74) | ENTPD1TRPM2P2RY1 |
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-20040043955-A1 | C8-substituted purine nucleotide analogs and their use as inhibitors of nucleoside triphosphate diphosphohydrolases | BEAUDOIN ADRIEN R (CA) | 2004-03-04 | — | — | US | disclosed |
| US-6617439-B1 | Adenine with a thioether substituent; use as enzyme inhibitors; modulates conversion into nucleosides | BAR-ILAN UNIVERSITY (IL) | 2003-09-09 | — | — | US | disclosed |