Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 5/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | GLS | O94925 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | MITF | O75030 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28829273 | 0.85 | LMNA (0.38) | PIN1HTTLMNAHPGDATM | |
| SCHEMBL16619910 | 0.85 | CYP19A1 (0.34) | HSP90AA1PIN1HTTLMNAHPGD | |
| SCHEMBL18024520 | 0.83 | ALDH1A1 (0.35) | HSP90AA1PIN1HTTLMNAHPGD | |
| SCHEMBL28067984 | 0.82 | PIN1 (0.34) | HSP90AA1PIN1HTTLMNAHPGD | |
| SCHEMBL16619583 | 0.82 | PIN1 (0.32) | HSP90AA1PIN1HTTLMNAHPGD | |
| SCHEMBL16619703 | 0.80 | PIN1 (0.36) | HSP90AA1PIN1GLSALDH1A1CYP1A2 | |
| SCHEMBL16619914 | 0.80 | CYP1A2 (0.42) | PIN1LMNAHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL20475244 | 0.80 | HSP90AA1 (0.32) | HSP90AA1PIN1HTTLMNAHPGD | |
| SCHEMBL29447518 | 0.78 | MAPT (0.42) | HTTLMNASMN1; SMN2GLSALDH1A1 | |
| SCHEMBL2279071 | 0.78 | GLS (0.50) | LMNASMN1; SMN2GLSALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105636586-A | ERK inhibitors and methods of use | ARAXES PHARMA LLC | 2016-06-01 | — | — | CN | disclosed |