Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.60 |
| ▸ | IDO1 | P14902 | 2/20 | 0.56 |
| ▸ | RXRA | P19793 | 1/20 | 0.51 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.47 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14611352 | 0.81 | CYP2D6 (0.58) | MAOBIDO1MAOALMNASGMS2 | |
| SCHEMBL19513571 | 0.79 | MAOB (0.53) | MAOBRXRAGRIN1GRIN2BMAOA | |
| SCHEMBL8491985 | 0.78 | MAOB (0.62) | MAOBIDO1MAOATHRATHRB | |
| SCHEMBL15344203 | 0.77 | MAOB (0.80) | MAOBIDO1MAOAACHE | |
| SCHEMBL27955213 | 0.76 | IDO1 (0.64) | MAOBIDO1MAOALMNATAAR1 | |
| SCHEMBL2779108 | 0.76 | LTA4H (0.55) | MAOBIDO1MAOALMNACYP1A2 | |
| SCHEMBL6667381 | 0.76 | IDO1 (0.69) | MAOBIDO1MAOATAAR1ACHE | |
| SCHEMBL15781849 | 0.76 | MAOB (0.67) | MAOBIDO1MAOAACHE | |
| SCHEMBL257781 | 0.76 | MAOB (0.69) | MAOBIDO1MAOAACHE | |
| SCHEMBL10204868 | 0.76 | MAOB (0.72) | MAOBIDO1MAOA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999019304-A9 | ALPHA-ALKYLTHIO SUBSTITUTED PYRIMIDINE ETHERS AND THIOETHERS AS VIRAL REVERSE TRANSCRIPTASE INHIBITORS | UPJOHN CO (US) | 1999-07-08 | — | — | WO | disclosed |