Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.32 |
| ▸ | PTGES | O14684 | 7/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.31 |
| ▸ | STAT1 | P42224 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.30 |
| ▸ | RAF1 | P04049 | 1/20 | 0.30 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.30 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22389542 | 0.99 | KDM4E (0.33) | KDM4ENPC1ALDH1A1RAB9AGPR55 | |
| SCHEMBL22389559 | 0.98 | KDM4E (0.32) | KDM4ENPC1ALDH1A1RAB9AGPR55 | |
| SCHEMBL10919663 | 0.98 | KDM4E (0.32) | KDM4ENPC1ALDH1A1RAB9AGPR55 | |
| SCHEMBL9764619 | 0.98 | KDM4E (0.32) | KDM4ENPC1ALDH1A1RAB9AGPR55 | |
| SCHEMBL11324162 | 0.87 | NPBWR1 (0.30) | — | |
| SCHEMBL9764162 | 0.85 | STAT3 (0.31) | PTGESSTAT3STAT1 | |
| SCHEMBL22389541 | 0.85 | NPC1 (0.33) | NPC1ALDH1A1RAB9ASTAT3STAT1 | |
| SCHEMBL270828 | 0.84 | MGAM (0.33) | KDM4ENPC1ALDH1A1RAB9ASTAT3 | |
| SCHEMBL22389540 | 0.84 | STAT3 (0.32) | PTGESSTAT3STAT1 | |
| SCHEMBL38285 | 0.84 | NPC1 (0.33) | KDM4ENPC1ALDH1A1RAB9ASTAT3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5018380-A | Organometallic gas carrier in interpenetrating polymer network | ALLIED-SIGNAL INC. (US) | 1991-05-28 | — | — | US | disclosed |
| US-4627859-A | ORGANOMETALLIC GAS CARRIER INTERDISPERSED IN INTERPENE TRATING POLYMER NETWORK MATRIX | ALLIED CORPORATION (US) | 1986-12-09 | — | — | US | disclosed |