Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.50 |
| ▸ | RELA | Q04206 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL717650 | 0.83 | GRM8 (0.49) | ALDH1A1TBXAS1CYP2C9CYP2C19F7 | |
| SCHEMBL22361431 | 0.83 | LMNA (0.55) | LMNAL3MBTL1MAPTNFKB1NFKB2 | |
| SCHEMBL9344802 | 0.82 | CES2 (0.50) | POLBALDH1A1KMT2A | |
| SCHEMBL28574985 | 0.82 | CES2 (0.50) | POLBALDH1A1KMT2A | |
| SCHEMBL27601968 | 0.82 | F7 (0.53) | LMNAL3MBTL1NPC1SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL928942 | 0.81 | MMP2 (0.49) | MAPTPOLBNPC1ALDH1A1HTT | |
| Hydrochloric Acid SCHEMBL2821000 | 0.81 | F7 (0.51) | LMNAL3MBTL1NPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL27287213 | 0.81 | CES2 (0.49) | — | |
| Hydrochloric Acid SCHEMBL9449101 | 0.79 | CES2 (0.47) | MAPTNPC1HTT | |
| SCHEMBL27951597 | 0.78 | TBXAS1 (0.50) | ALDH1A1TBXAS1F7F3SARM1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4994462-A | N,N-Bis(nipecotyl)piperazines | RESEARCH CORPORATION (US) | 1991-02-19 | — | — | US | disclosed |
| US-4798830-A | TETRAHYDROQUINOLINE DERIVATIVES | RESEARCH CORPORATION (US) | 1989-01-17 | — | — | US | disclosed |
| US-4634709-A | PIPERIDINE DERIVATIVES | RESEARCH CORPORATION (US) | 1987-01-06 | — | — | US | disclosed |
| US-4443450-A | N,N*-BIS(NIPECOTYL) PIPERAZINE | RESEARCH CORPORATION (US) | 1984-04-17 | — | — | US | disclosed |