Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GMNN | O75496 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CCR3 | P51677 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 3/20 | 0.45 |
| ▸ | BACE1 | P56817 | 3/20 | 0.45 |
| ▸ | BCHE | P06276 | 2/20 | 0.45 |
| ▸ | SCN1A | P35498 | 5/20 | 0.45 |
| ▸ | SCN8A | Q9UQD0 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9092750 | 0.81 | ACHE (0.43) | CCR3ACHEBACE1BCHESCN1A | |
| SCHEMBL8792841 | 0.77 | ACHE (0.49) | ALDH1A1DRD2SMN1; SMN2CCR3ACHE | |
| SCHEMBL8409470 | 0.75 | DRD2 (0.53) | GMNNALDH1A1LMNADRD2HPGD | |
| SCHEMBL8793282 | 0.73 | ACHE (0.47) | ALDH1A1SMN1; SMN2CCR3ACHEBACE1 | |
| SCHEMBL21375648 | 0.71 | SIGMAR1 (0.60) | GMNNALDH1A1LMNADRD2HPGD | |
| SCHEMBL7286179 | 0.70 | ACHE (0.53) | GMNNALDH1A1LMNADRD2HPGD | |
| SCHEMBL8410128 | 0.70 | GMNN (0.41) | GMNNALDH1A1LMNADRD2HPGD | |
| SCHEMBL2108897 | 0.69 | ACHE (0.66) | DRD2DRD4DRD3CCR3ACHE | |
| SCHEMBL9093241 | 0.68 | MEN1 (0.45) | ALDH1A1CCR3ACHEBACE1BCHE | |
| SCHEMBL3311545 | 0.68 | ACHE (0.60) | GMNNALDH1A1LMNADRD2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5866589-A | Alkyl substituted piperadinyl and piperazinyl anti-AIDS compounds | PHARMACIA & UPJOHN COMPANY (US) | 1999-02-02 | — | — | US | disclosed |
| EP-0797576-A1 | ALKYL SUBSTITUTED PIPERADINYL AND PIPERAZINYL ANTI-AIDS COMPOUNDS | PHARMACIA & UPJOHN COMPANY (US) | 1997-10-01 | — | — | EP | disclosed |
| WO-1996018628-A1 | ALKYL SUBSTITUTED PIPERADINYL AND PIPERAZINYL ANTI-AIDS COMPOUNDS | PHARMACIA & UPJOHN COMPANY (US) | 1996-06-20 | — | — | WO | disclosed |