Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTR3A | P46098 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9050178 | 0.91 | KMT2A (0.52) | KMT2AMEN1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL9049451 | 0.77 | NPC1 (0.48) | KMT2AMEN1ALDH1A1HSD17B10HPGD | |
| SCHEMBL7327993 | 0.77 | HTR3A (0.50) | KDM4EALDH1A1HTR3AADRA2AADRA2B | |
| SCHEMBL8542781 | 0.76 | HTR3A (0.50) | KDM4EHTR3AADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL9050935 | 0.76 | HTR3A (0.48) | ALDH1A1HTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL7333796 | 0.74 | ADRA1A (0.47) | KMT2AMEN1ALDH1A1HPGDHTR3A | |
| SCHEMBL12648964 | 0.73 | KMT2A (0.84) | KMT2AMEN1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL7328013 | 0.73 | HTR3A (0.41) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL7324856 | 0.73 | HTR3A (0.51) | KDM4EALDH1A1HSD17B10HPGDHTR3A | |
| SCHEMBL8482518 | 0.73 | PDK1 (0.49) | KMT2AKDM4EALDH1A1HTR3AADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0381422-B1 | Tetrahydrobenzimidazole derivatives | YAMANOUCHI PHARMA CO LTD (JP) | 1996-10-23 | — | — | EP | disclosed |
| US-5496942-A | 5-HT3-RECEPTOR ANTAGONISTS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1996-03-05 | — | — | US | disclosed |
| US-5344927-A | 5-HT3 antagonist | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1994-09-06 | — | — | US | disclosed |
| EP-0381422-A1 | Tetrahydrobenzimidazole derivatives | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1990-08-08 | — | — | EP | disclosed |