Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 13/20 | 0.62 |
| ▸ | IDO1 | P14902 | 2/20 | 0.56 |
| ▸ | AGXT | P21549 | 2/20 | 0.56 |
| ▸ | MAOA | P21397 | 4/20 | 0.50 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.49 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.49 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31173205 | 0.81 | NPC1 (0.58) | MAOBIDO1AGXTMAOAPARP15 | |
| SCHEMBL22290322 | 0.81 | NPC1 (0.58) | MAOBIDO1AGXTMAOAPARP15 | |
| SCHEMBL31173412 | 0.79 | MAOB (0.69) | MAOBIDO1AGXTMAOAPARP15 | |
| SCHEMBL22290667 | 0.79 | MAOB (0.69) | MAOBIDO1AGXTMAOAPARP15 | |
| SCHEMBL8488996 | 0.78 | MAOB (0.60) | MAOBIDO1MAOATHRATHRB | |
| SCHEMBL4404036 | 0.77 | MAOB (1.00) | MAOBIDO1AGXTMAOAPARP15 | |
| SCHEMBL12256032 | 0.76 | MAOB (0.66) | MAOBIDO1AGXTMAOAPARP15 | |
| SCHEMBL27844033 | 0.76 | NPC1 (0.62) | MAOB | |
| SCHEMBL2779108 | 0.76 | LTA4H (0.55) | MAOBIDO1AGXTMAOA | |
| SCHEMBL1767187 | 0.76 | IDO1 (0.69) | MAOBIDO1AGXTMAOAPARP15 |
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 |