Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 4/20 | 0.45 |
| ▸ | DHFR | P00374 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | RORB | Q92753 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL28827012 | 0.80 | MAP4K4 (0.43) | NPC1MAPTRAB9ASMN1; SMN2NOTUM | |
| SCHEMBL24809520 | 0.79 | TDP1 (0.47) | RAB9ASMN1; SMN2MAP4K4S1PR4CYP19A1 | |
| SCHEMBL24809555 | 0.79 | CYP11B1 (0.39) | S1PR4NPY5R | |
| SCHEMBL5666351 | 0.79 | PIK3CD (0.53) | MAP4K4ADORA1CYP19A1KDR | |
| SCHEMBL3875933 | 0.79 | CYP11B2 (0.55) | NUDT1DHFRMAPTTDO2RORB | |
| SCHEMBL7444875 | 0.77 | BRD4 (0.52) | NUDT1DHFRTP53MAPTTSHR | |
| SCHEMBL1203598 | 0.77 | ALDH1A1 (0.50) | MAP4K4 | |
| SCHEMBL28404602 | 0.76 | NUDT1 (0.51) | NUDT1DHFRTDO2RORBADORA2A | |
| SCHEMBL15676581 | 0.75 | LOXL2 (0.47) | NUDT1DHFRNPC1MAPTRAB9A | |
| SCHEMBL4819319 | 0.75 | PDE4A (0.44) | MAP4K4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022267901-A1 | ORGANIC COMPOUND, ELECTRONIC COMPONENT. AND ELECTRONIC DEVICE | 陕西莱特光电材料股份有限公司 | 2022-12-29 | — | — | WO | disclosed |