Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.40 |
| ▸ | TUBB | P07437 | 2/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.40 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8059219 | 0.93 | KDM4E (0.44) | MTNR1AMTNR1BKDM4EAURKAMAPK10 | |
| SCHEMBL8068336 | 0.77 | BRD4 (0.49) | KDM4EAURKAMAPK10RIPK1HTR6 | |
| SCHEMBL8068409 | 0.76 | ALDH1A1 (0.48) | KDM4EAURKAMAPK10RIPK1HTR6 | |
| SCHEMBL9364035 | 0.75 | HSD11B1 (0.42) | MTNR1AMTNR1BKDM4EHTR6ALDH1A1 | |
| SCHEMBL8070427 | 0.71 | PARP1 (0.38) | KDM4EALDH1A1HSD17B10HPGDHTR1A | |
| SCHEMBL8070432 | 0.70 | PARP1 (0.37) | KDM4EALDH1A1HTR1ADRD2 | |
| SCHEMBL6624045 | 0.70 | PARP1 (0.48) | DRD2 | |
| SCHEMBL27408415 | 0.70 | ALDH1A1 (0.54) | KDM4EHTR6ALDH1A1HSD17B10TUBB4A | |
| SCHEMBL21485065 | 0.69 | DRD2 (0.45) | MAPK10ALDH1A1HSD17B10TSHRDRD2 | |
| SCHEMBL8069946 | 0.69 | KMT2A (0.41) | KDM4EALDH1A1HPGDTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0803501-B1 | Substituted guanidine derivatives and their use as Na+/H+ exchange inhibitors | SUMITOMO PHARMA (JP) | 2000-07-05 | — | — | EP | disclosed |
| EP-0803501-A1 | Substituted guanidine derivatives and their use as Na+/H+ exchange inhibitors | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1997-10-29 | — | — | EP | disclosed |