Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27678850 | 0.77 | CYP3A4 (0.32) | RAB9AMTNR1AMTNR1BSMN1; SMN2NPC1 | |
| SCHEMBL23997326 | 0.77 | RAB9A (0.42) | RAB9AMTNR1AMTNR1BALDH1A1PTK2 | |
| SCHEMBL23997494 | 0.77 | HRH3 (0.38) | MTNR1AMTNR1B | |
| SCHEMBL9494 | 0.76 | RAB9A (0.47) | RAB9AALDH1A1PTK2SMN1; SMN2NPC1 | |
| SCHEMBL25986524 | 0.72 | LTA4H (0.81) | ALDH1A1LTA4HSMN1; SMN2LMNATSHR | |
| SCHEMBL1425001 | 0.72 | LTA4H (0.81) | ALDH1A1LTA4HSMN1; SMN2LMNATSHR | |
| SCHEMBL27884 | 0.72 | LTA4H (0.81) | ALDH1A1LTA4HSMN1; SMN2LMNATSHR | |
| Ammonia Solution, Strong SCHEMBL20919857 | 0.70 | LTA4H (0.77) | ALDH1A1LTA4HSMN1; SMN2LMNATSHR | |
| SCHEMBL4581181 | 0.69 | NOTUM (0.65) | RAB9AALDH1A1SMN1; SMN2NPC1L3MBTL1 | |
| SCHEMBL554787 | 0.69 | KLKB1 (0.54) | RAB9AALDH1A1LTA4HSMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1143958-A | (4,4-difluorobut-3-enylthio-)-substituted heterocyclic or carbocyclic ring compounds | ZENECA LTD (GB) | 1997-02-26 | — | — | CN | disclosed |