Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.63 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | CASP4 | P49662 | 1/20 | 0.56 |
| ▸ | CASP5 | P51878 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12511057 | 0.84 | ACHE (0.74) | MEN1POLBKMT2AACHEALDH1A1 | |
| SCHEMBL8168650 | 0.79 | ALDH1A1 (0.57) | POLBACHEALDH1A1KDM4ELMNA | |
| SCHEMBL2372693 | 0.78 | ACHE (0.70) | MEN1POLBKMT2AACHEALDH1A1 | |
| SCHEMBL8172177 | 0.78 | ALDH1A1 (0.77) | MEN1KMT2AALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL4520581 | 0.78 | KMT2A (0.61) | MEN1POLBKMT2AALDH1A1LMNA | |
| SCHEMBL4586698 | 0.77 | ACHE (0.69) | MEN1POLBKMT2AACHEALDH1A1 | |
| SCHEMBL14351628 | 0.77 | ACHE (0.68) | MEN1POLBKMT2AACHEALDH1A1 | |
| SCHEMBL8169796 | 0.77 | HTR7 (0.71) | ALDH1A1KDM4ETDP1DRD4 | |
| SCHEMBL21044130 | 0.77 | ALDH1A1 (0.61) | MEN1POLBKMT2AACHEALDH1A1 | |
| SCHEMBL8168498 | 0.76 | MEN1 (0.64) | MEN1POLBKMT2AALDH1A1KDM4E |
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-5998414-A | PSYCHOLOGICAL DISORDERS | HOECHST MARION ROUSSEL, INC. (US) | 1999-12-07 | — | — | US | disclosed |
| EP-0929537-A1 | TROPONYL PIPERAZINES AS SELECTIVE DOPAMINE D4 RECEPTOR LIGANDS | HOECHST MARION ROUSSEL, INC. (US) | 1999-07-21 | — | — | EP | disclosed |
| WO-1998007711-A1 | TROPONYL PIPERAZINES AS SELECTIVE DOPAMINE D4 RECEPTOR LIGANDS | HOECHST MARION ROUSSEL, INC. (US) | 1998-02-26 | — | — | WO | disclosed |