Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LIPE | Q05469 | 5/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | GPR183 | P32249 | 4/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.37 |
| ▸ | SCN7A | Q01118 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.37 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.37 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.37 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25315094 | 0.83 | HRH3 (0.40) | HRH3LIPEBCHEKCNH2SCN7A | |
| SCHEMBL26633220 | 0.83 | SCN9A (0.52) | HRH3LIPEBCHEKCNH2SCN7A | |
| SCHEMBL30117294 | 0.82 | CYP4F2 (0.43) | HRH3SMN1; SMN2GPR183KCNH2SCN7A | |
| SCHEMBL30117296 | 0.82 | CYP4F2 (0.43) | HRH3SMN1; SMN2GPR183KCNH2SCN7A | |
| SCHEMBL18281398 | 0.81 | TPSAB1 (0.36) | HRH3NPC1LMNAMAPTRAB9A | |
| SCHEMBL20476683 | 0.80 | TSHR (0.33) | HRH3GPR183KCNH2SCN9AAKR1C3 | |
| SCHEMBL25313199 | 0.79 | ALDH1A1 (0.44) | LMNAMAPTTDP1KCNH2KDM4E | |
| SCHEMBL17979079 | 0.77 | REN (0.36) | HRH3NPC1LMNAMAPTRAB9A | |
| SCHEMBL18343850 | 0.77 | SCN9A (0.38) | NPC1LMNAMAPTRAB9AATM | |
| SCHEMBL19717800 | 0.77 | SCN7A (0.47) | SMN1; SMN2L3MBTL1KCNH2SCN7ASIGMAR1 |
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-2023104111-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PI3KALPHA INHIBITORS | NANJING ZENSHINE PHARMACEUTICALS CO., LTD. (CN) | 2023-06-15 | — | — | WO | disclosed |
| WO-2016192657-A1 | SUBSTITUTED PIPERAZINE COMPOUNDS AND METHODS OF USE AND USE THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-12-08 | — | — | WO | disclosed |
| WO-2016127358-A1 | INHIBITORS OF RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2016-08-18 | — | — | WO | disclosed |