Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | QDPR | P09417 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 10/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.33 |
| ▸ | DRD2 | P14416 | 6/20 | 0.33 |
| ▸ | RECQL | P46063 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | BLM | P54132 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.33 |
| ▸ | THPO | P40225 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | DRD5 | P21918 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11553565 | 0.81 | QDPR (0.51) | QDPRDRD1KDM4EDRD2MAPT | |
| SCHEMBL6131967 | 0.74 | ESR2 (0.38) | DRD1KDM4EDRD2RECQLMAPT | |
| SCHEMBL14258976 | 0.74 | BMPR1B (0.34) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL16026423 | 0.74 | HTR3A (0.36) | CYP2D6TSHRHTR1AADRA2ASLC6A2 | |
| SCHEMBL27432364 | 0.74 | OPRM1 (0.34) | OPRM1ADCY5 | |
| SCHEMBL11555527 | 0.74 | CA2 (0.50) | QDPRCYP3A4MEN1TSHRKMT2A | |
| Piperazine SCHEMBL28078183 | 0.73 | ADRB1 (0.37) | CYP2D6TSHRHTR1AADRA2ASLC6A2 | |
| Hydrochloric Acid SCHEMBL27459404 | 0.73 | HTR2C (0.36) | OPRM1 | |
| Hydrochloric Acid SCHEMBL11553193 | 0.73 | ESR2 (0.37) | DRD1KDM4EDRD2RECQLMAPT | |
| Hydrochloric Acid SCHEMBL11551113 | 0.73 | TSHR (0.49) | QDPRCYP3A4MEN1TSHRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4166180-A | 2-ARYLPIPERAZINE DERIVATIVES AND THE PREPARATION THEREOF | HOKURIKU PHARMACEUTICAL CO., LTD. (JP) | 1979-08-28 | — | — | US | disclosed |