Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | PRCP | P42785 | 6/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.42 |
| ▸ | CHRNA2 | Q15822 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.42 |
| ▸ | CHRNG | P07510 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11682895 | 0.86 | KCNH2 (0.57) | OPRD1KCNH2PRCPSIGMAR1LMNA | |
| Bromide SCHEMBL11735141 | 0.81 | OPRD1 (0.43) | OPRD1KCNH2PRCPSIGMAR1CHRNA7 | |
| SCHEMBL11858464 | 0.79 | OPRD1 (0.47) | OPRD1KCNH2PRCPSIGMAR1 | |
| SCHEMBL11867362 | 0.79 | PRCP (0.50) | OPRD1KCNH2PRCPSIGMAR1 | |
| SCHEMBL11851978 | 0.78 | KCNH2 (0.52) | OPRD1KCNH2PRCPSIGMAR1LMNA | |
| SCHEMBL11857141 | 0.77 | SIGMAR1 (0.50) | OPRD1KCNH2PRCPSIGMAR1 | |
| SCHEMBL11864088 | 0.73 | SIGMAR1 (0.54) | OPRD1SIGMAR1 | |
| SCHEMBL11730973 | 0.72 | SIGMAR1 (0.45) | OPRD1KCNH2PRCPSIGMAR1 | |
| SCHEMBL11684960 | 0.72 | OPRD1 (0.57) | OPRD1KCNH2PRCPSIGMAR1 | |
| SCHEMBL11681373 | 0.72 | OPRD1 (0.60) | OPRD1KCNH2PRCPSIGMAR1 |
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-4031224-A | 1,3-Dihydro-heteroarylspiro (isobenzofuran)s | AMERICAN HOECHST CORPORATION (US) | 1977-06-21 | — | — | US | claimed |
| US-4031224-A | 1,3-Dihydro-heteroarylspiro (isobenzofuran)s | AMERICAN HOECHST CORPORATION (US) | 1977-06-21 | — | — | US | disclosed |