Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SDHB | P21912 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17364632 | 0.78 | CFTR (0.43) | CFTRNPC1SOS1MAPTKDM4E | |
| SCHEMBL1529046 | 0.73 | KDM4E (0.39) | NPC1CASP3RAB9ASMN1; SMN2SENP8 | |
| SCHEMBL1529029 | 0.70 | MAPT (0.46) | RAB9AMAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL24986973 | 0.68 | ALPL (0.40) | SMN1; SMN2CD274KDM4EALPLALDH1A1 | |
| SCHEMBL10667889 | 0.68 | TUBB4A (0.54) | CFTRNPC1CASP3RAB9ASMN1; SMN2 | |
| SCHEMBL27702568 | 0.68 | CFTR (0.46) | CFTRNPC1CASP3RAB9ASMN1; SMN2 | |
| SCHEMBL5005835 | 0.68 | NPC1 (0.54) | CFTRNPC1CASP3RAB9ASMN1; SMN2 | |
| SCHEMBL4035807 | 0.67 | KDM4E (0.46) | SMN1; SMN2MAPTKDM4ECYP1A2CYP2D6 | |
| SCHEMBL28830749 | 0.67 | XPO1 (0.55) | CFTRNPC1CASP3RAB9ASMN1; SMN2 | |
| SCHEMBL30751960 | 0.67 | XPO1 (0.55) | CFTRNPC1CASP3RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2632269-A1 | CYCLIC AMINE SUBSTITUTED OXAZOLIDINONE CETP INHIBITOR | Merck Sharp & Dohme Corp. (US) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012058187-A1 | CYCLIC AMINE SUBSTITUTED OXAZOLIDINONE CETP INHIBITOR | MERCK SHARP & DOHME CORP. (US) | 2012-05-03 | — | — | WO | disclosed |