Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4469156 | 0.80 | CNR2 (0.49) | KDM4EUSP2ALDH1A1POLBADRA2A | |
| SCHEMBL30471915 | 0.74 | ALDH1A1 (0.50) | KDM4EUSP2ALDH1A1CNR2MAPK1 | |
| SCHEMBL4767726 | 0.69 | CNR2 (0.57) | KDM4EALDH1A1POLBADRA2ACNR2 | |
| SCHEMBL19147985 | 0.68 | CNR2 (0.63) | KDM4EALDH1A1ADRA2ACNR2 | |
| SCHEMBL4768929 | 0.67 | POLB (0.59) | KDM4EALDH1A1POLBADRA2ACNR2 | |
| SCHEMBL11730694 | 0.66 | ADRA2A (0.44) | KDM4EALDH1A1ADRA2ACNR2TYR | |
| SCHEMBL10531764 | 0.65 | POLB (0.43) | KDM4EUSP2ALDH1A1POLBADRA2A | |
| SCHEMBL4467734 | 0.65 | TSHR (0.43) | KDM4EUSP2ALDH1A1TSHRMAPT | |
| SCHEMBL4469664 | 0.65 | KDM4E (0.45) | KDM4EUSP2ALDH1A1MEN1KMT2A | |
| SCHEMBL8175634 | 0.65 | ADRA2A (0.50) | KDM4EALDH1A1ADRA2ACNR2 |
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-7449473-B2 | Substituted pyrrolo[3,2-d]pyrimidin-2,4-diones as A2b adenosine receptor antagonists | CV THERAPEUTICS, INC. (US) | 2008-11-11 | — | — | US | disclosed |
| US-7449473-B2 | Substituted pyrrolo[3,2-d]pyrimidin-2,4-diones as A2b adenosine receptor antagonists | CV THERAPEUTICS, INC. (US) | 2008-11-11 | — | — | US | disclosed |