Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 9/20 | 0.67 |
| ▸ | ITGA2B | P08514 | 9/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | RECQL | P46063 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | HTR7 | P34969 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | MMP2 | P08253 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL27786793 | 0.85 | MAPT (0.78) | ALDH1A1HPGDHSD17B10KDM4ECYP3A4 | |
| SCHEMBL7790344 | 0.85 | ITGB3 (0.60) | ITGB3ITGA2BALDH1A1HPGDHSD17B10 | |
| SCHEMBL13801421 | 0.84 | MAPT (0.58) | ITGB3ITGA2BSMN1; SMN2LMNAMAPT | |
| SCHEMBL6600563 | 0.84 | MAPT (0.62) | ITGB3ITGA2BCYP3A4CYP2C9LMNA | |
| SCHEMBL4383007 | 0.84 | MAPT (0.58) | ITGB3ITGA2BALDH1A1SMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL4376006 | 0.83 | MAPT (0.57) | ITGB3ITGA2BALDH1A1LMNAMAPT | |
| SCHEMBL17859454 | 0.81 | ALDH1A1 (0.64) | ALDH1A1HPGDHSD17B10SMN1; SMN2LMNA | |
| SCHEMBL10015690 | 0.81 | ALDH1A1 (0.86) | ALDH1A1HPGDHSD17B10SMN1; SMN2LMNA | |
| SCHEMBL8776300 | 0.81 | MAPT (0.61) | ITGB3ITGA2BSMN1; SMN2LMNAMAPT | |
| SCHEMBL7790352 | 0.80 | ITGB3 (0.60) | ITGB3ITGA2BALDH1A1KDM4ESMN1; SMN2 |
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-6242600-B1 | ANTIISCHEMIC AGENTS, ANTICOAGULANTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-0970071-A1 | 2-PEPERAZINONE-1-ACETIC ACID DERIVATIVES AND THEIR USE | Takeda Chemical Industries, Ltd. (JP) | 2000-01-12 | — | — | EP | disclosed |
| WO-1998039324-A1 | 2-PEPERAZINONE-1-ACETIC ACID DERIVATIVES AND THEIR USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-11 | — | — | WO | disclosed |