Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 1/20 | 0.49 |
| ▸ | DPP4 | P27487 | 2/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.42 |
| ▸ | CD38 | P28907 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL25696647 | 0.89 | PDE7A (0.43) | CHRM4DPP4ABL1ALDH1A1NPC1 | |
| SCHEMBL25696643 | 0.89 | PDE7A (0.43) | CHRM4DPP4ABL1ALDH1A1NPC1 | |
| SCHEMBL27398490 | 0.86 | BRD4 (0.42) | CHRM4DPP4ABL1ALDH1A1NPC1 | |
| SCHEMBL25696639 | 0.84 | SCN9A (0.48) | CHRM4ABL1NPC1RAB9A | |
| SCHEMBL25236780 | 0.84 | ALDH1A1 (0.46) | CHRM4DPP4ALDH1A1NPC1RAB9A | |
| SCHEMBL25912411 | 0.84 | ABL1 (0.49) | CHRM4DPP4ABL1ALDH1A1NPC1 | |
| SCHEMBL25690421 | 0.84 | DPP4 (0.45) | CHRM4DPP4ALDH1A1NPC1RAB9A | |
| SCHEMBL25696652 | 0.83 | CHRNB2 (0.48) | ALDH1A1CD38 | |
| SCHEMBL25690680 | 0.82 | CNR2 (0.54) | ALDH1A1NPC1RAB9ACD38PARP1 | |
| SCHEMBL16599617 | 0.78 | ALDH1A1 (0.50) | DPP4ALDH1A1NPC1RAB9AHSD11B1 |
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-2024050370-A1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | 1CBIO, INC. (US) | 2024-03-07 | — | — | WO | disclosed |
| WO-2023122140-A1 | PARP1 INHIBITORS | SYNNOVATION THERAPEUTICS, INC. (US) | 2023-06-29 | — | — | WO | disclosed |