Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | PRKCI | P41743 | 8/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | PDE5A | O76074 | 2/20 | 0.43 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | METAP2 | P50579 | 1/20 | 0.42 |
| ▸ | METAP1 | P53582 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5114959 | 0.94 | KDM4E (0.59) | KDM4EMAPK1PRKCIHTTGAA | |
| SCHEMBL7515376 | 0.91 | ALDH1A1 (0.56) | KDM4EMAPK1ESR1PDE5APDE4A | |
| SCHEMBL5121541 | 0.84 | GBA1 (0.60) | KDM4EMAPK1PDE5APDE4APDE4B | |
| SCHEMBL5123718 | 0.83 | PDE4A (0.58) | PRKCIESR1PDE5ATGFBR1PDE4A | |
| SCHEMBL8177979 | 0.82 | PDE5A (0.45) | KDM4EMAPK1PRKCIESR1PDE5A | |
| SCHEMBL5122356 | 0.81 | PRKCI (0.60) | KDM4EMAPK1PRKCIHTTGAA | |
| SCHEMBL7514873 | 0.80 | ALDH1A1 (0.58) | KDM4EMAPK1ESR1PDE5APDE4A | |
| SCHEMBL5127935 | 0.80 | PRKCI (0.51) | KDM4EPRKCITGFBR1RAB9ASMN1; SMN2 | |
| SCHEMBL5117852 | 0.79 | METAP1 (0.61) | KDM4EMAPK1HTTGAAESR1 | |
| SCHEMBL8187376 | 0.79 | MGLL (0.44) | KDM4EMAPK1PRKCIESR1PDE5A |
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-1685136-A1 | USE OF THIENOPYRIMIDINES | MERCK PATENT GmbH (DE) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005047292-A1 | USE OF THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 2005-05-26 | — | — | WO | disclosed |