Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.55 |
| ▸ | HTR2C | P28335 | 6/20 | 0.54 |
| ▸ | KMO | O15229 | 1/20 | 0.51 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.48 |
| ▸ | QDPR | P09417 | 1/20 | 0.47 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | TYK2 | P29597 | 1/20 | 0.46 |
| ▸ | JAK3 | P52333 | 1/20 | 0.46 |
| ▸ | MLYCD | O95822 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL16210633 | 0.98 | HTR2C (0.55) | PARP1HTR2CKMOSLC18A3SIGMAR1 | |
| SCHEMBL30344892 | 0.91 | PARP1 (0.53) | PARP1KMOOPRM1OPRD1JAK3 | |
| Hydrochloric Acid SCHEMBL28155975 | 0.89 | PARP1 (0.51) | PARP1HTR2CKMOOPRM1OPRD1 | |
| Hydrochloric Acid SCHEMBL28155974 | 0.89 | PARP1 (0.51) | PARP1HTR2CKMOOPRM1OPRD1 | |
| SCHEMBL1036815 | 0.88 | PARP1 (0.64) | PARP1KMOOPRM1OPRD1MLYCD | |
| SCHEMBL1633310 | 0.85 | KMO (0.71) | HTR2CKMOSLC18A3SIGMAR1QDPR | |
| SCHEMBL29503161 | 0.85 | KMO (0.65) | PARP1KMOOPRM1OPRD1MLYCD | |
| SCHEMBL28330716 | 0.85 | KMO (0.65) | PARP1KMOOPRM1OPRD1MLYCD | |
| SCHEMBL1668686 | 0.84 | HTR2C (0.54) | PARP1HTR2CKMOSLC18A3SIGMAR1 | |
| SCHEMBL12577717 | 0.84 | HTR2C (0.58) | HTR2CKMOSLC18A3SIGMAR1QDPR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023064493-A1 | COMPOUNDS AND METHODS FOR TREATING CORONAVIRUSES | Clear Creek Bio, Inc. (US) | 2023-04-20 | — | — | WO | disclosed |
| WO-2022220725-A1 | LPXH INHIBITORS AS ANTI-INFECTIVE AGENTS | ZAMARATSKI EDOUARD (SE) | 2022-10-20 | — | — | WO | disclosed |