Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.49 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 5/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10556923 | 0.85 | NOTUM (0.40) | NOTUMRAB9ANPC1MAPTSMN1; SMN2 | |
| SCHEMBL10556449 | 0.77 | KDM4E (0.42) | NOTUMMAPTSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL10642049 | 0.76 | NPC1 (0.36) | NOTUMCHEK2RAB9ANPC1HDAC6 | |
| SCHEMBL10559142 | 0.75 | CDK4 (0.41) | NOTUMMAPTSMN1; SMN2NPBWR1SCD | |
| SCHEMBL10555632 | 0.72 | NOTUM (0.47) | NOTUMRAB9AMAPTSMN1; SMN2HDAC6 | |
| SCHEMBL10557907 | 0.72 | NOTUM (0.51) | NOTUMKDM4EALDH1A1CYP3A4 | |
| SCHEMBL15563980 | 0.70 | NPC1 (0.51) | CHEK2RAB9ANPC1MAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL10555631 | 0.69 | NPC1 (0.46) | CHEK2RAB9ANPC1MAPTSMN1; SMN2 | |
| SCHEMBL9866893 | 0.68 | MMP2 (0.56) | CHEK2KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL10375588 | 0.68 | PDE4A (0.71) | CHEK2RAB9ANPC1MAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4863945-A | CARDIOVASCULAR DISORDERS | BOEHRINGER MANNHEIM GMBH (DE) | 1989-09-05 | — | — | US | disclosed |
| EP-0271040-A2 | Pyrrolobenzimidazoles, process for their preparation, and medicaments | Roche Diagnostics GmbH (DE) | 1988-06-15 | — | — | EP | disclosed |