Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.63 |
| ▸ | RAB9A | P51151 | 4/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.59 |
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.55 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.54 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.54 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28376945 | 0.85 | SMN1; SMN2 (0.74) | NPC1RAB9ACYP2C9CYP1A2CYP3A4 | |
| SCHEMBL18257158 | 0.80 | KDR (0.72) | NPC1RAB9ASMN1; SMN2KDM4EGAA | |
| SCHEMBL21828979 | 0.79 | KDM4E (0.65) | NPC1RAB9ACYP2C9SMN1; SMN2KDM4E | |
| SCHEMBL28491241 | 0.79 | KDM4E (0.54) | NPC1RAB9ACYP2C9CYP1A2CYP3A4 | |
| SCHEMBL28499436 | 0.79 | KDM4E (0.66) | NPC1RAB9ACYP2C9CYP1A2CYP3A4 | |
| SCHEMBL11616061 | 0.79 | RAB9A (0.76) | NPC1RAB9ACYP2C9CYP1A2CYP3A4 | |
| SCHEMBL14027385 | 0.79 | KDM4E (0.66) | NPC1RAB9ASMN1; SMN2KDM4EGAA | |
| SCHEMBL21275460 | 0.77 | RAB9A (0.76) | NPC1RAB9ACYP2C9CYP1A2CYP3A4 | |
| SCHEMBL21914836 | 0.77 | NPC1 (0.80) | NPC1RAB9ACYP2C9CYP1A2CYP3A4 | |
| SCHEMBL4642544 | 0.77 | NPC1 (1.00) | NPC1RAB9ACYP2C9CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008056176-A1 | PYRAZOLOPYRIMIDINES AS PHOSPHODIESTERASE INHIBITORS | SCOTTISH BIOMEDICAL LIMITED (GB) | 2008-05-15 | — | — | WO | claimed |
| WO-2008056176-A1 | PYRAZOLOPYRIMIDINES AS PHOSPHODIESTERASE INHIBITORS | SCOTTISH BIOMEDICAL LIMITED (GB) | 2008-05-15 | — | — | WO | disclosed |