Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA4 | P43681 | 3/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | RAPGEF3 | O95398 | 1/20 | 0.34 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Cyclopropane Carboxylic Acid SCHEMBL27544465 | 0.79 | CHRNA4 (0.42) | CHRNA4CNR2NPC1RAB9ARAPGEF3 | |
| SCHEMBL27544464 | 0.78 | CHRNA4 (0.44) | CHRNA4CNR2NPC1RAB9ACHRNB2 | |
| SCHEMBL28273457 | 0.73 | CHRNA4 (0.44) | CHRNA4CNR2NPC1RAB9ARAPGEF3 | |
| SCHEMBL28215407 | 0.72 | CHRNA4 (0.41) | CHRNA4CNR2NPC1RAB9ARAPGEF3 | |
| SCHEMBL3367312 | 0.72 | NPC1 (0.43) | CHRNA4NPC1RAB9ACHRNB2CHRNA7 | |
| SCHEMBL14108403 | 0.72 | MLLT1 (0.47) | CHRNA4NPC1RAB9ACHRNB2CHRNA7 | |
| SCHEMBL1323514 | 0.72 | — | — | |
| SCHEMBL109365 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL28847292 | 0.71 | MLLT1 (0.46) | CHRNA4NPC1RAB9ACHRNB2CHRNA7 | |
| SCHEMBL325207 | 0.70 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995025105-A1 | ISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES | RHONE-POULENC AGRICULTURE LTD (GB) | 1995-09-21 | — | — | WO | disclosed |
| WO-1995025099-A1 | 2-CYANO-1,3-DIONE DERIVATIVES USEFUL AS HERBICIDES | RHONE-POULENC AGRICULTURE LTD. (GB) | 1995-09-21 | — | — | WO | disclosed |
| WO-1995022903-A1 | NEW PESTICIDAL METHOD | RHONE-POULENC AGROCHIMIE (FR) | 1995-08-31 | — | — | WO | disclosed |