Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.53 |
| ▸ | MITF | O75030 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CDK8 | P49336 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11640199 | 0.88 | TP53 (0.62) | ALDH1A1POLBMAPK1MITFHTT | |
| SCHEMBL11647308 | 0.87 | HPGD (0.56) | ALDH1A1POLBMAPK1MTNR1BHPGD | |
| SCHEMBL11645789 | 0.86 | MAPK1 (0.60) | ALDH1A1POLBMAPK1MITFHTT | |
| SCHEMBL11643242 | 0.85 | MAPK1 (0.55) | ALDH1A1NPC1RAB9APOLBMAPK1 | |
| SCHEMBL11644159 | 0.85 | HPGD (0.67) | ALDH1A1NPC1RAB9APOLBMAPK1 | |
| SCHEMBL11644514 | 0.84 | ALDH1A1 (0.73) | ALDH1A1NPC1POLBMAPK1MITF | |
| SCHEMBL11643915 | 0.84 | ADRA2C (0.55) | ALDH1A1NPC1RAB9APOLBMAPK1 | |
| SCHEMBL11689261 | 0.84 | MAPT (0.44) | ALDH1A1NPC1RAB9APOLBMAPK1 | |
| SCHEMBL11643798 | 0.83 | MTNR1B (0.73) | ALDH1A1NPC1RAB9AMTNR1BHPGD | |
| SCHEMBL14384403 | 0.83 | MTNR1A (0.58) | ALDH1A1NPC1RAB9AMAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4088780-A | ANTHELMINTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DT) | 1978-05-09 | — | — | US | disclosed |
| US-4032655-A | PHENYLGUANIDINES USEFUL AS ANTHELMINTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-06-28 | — | — | US | disclosed |
| US-4024176-A | Substituted phenylguanidines and processes for their preparation and use | BAYER AKTIENGESELLSCHAFT (DT) | 1977-05-17 | — | — | US | disclosed |
| US-3993682-A | Substituted phenylguanidines and processes for their preparation and use | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-23 | — | — | US | disclosed |