Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PER2 | O15055 | 1/20 | 0.33 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8633117 | 0.88 | PDE4B (0.40) | ALDH1A1LMNAHTTRIPK1MAPT | |
| SCHEMBL8636231 | 0.87 | MCL1 (0.33) | ALDH1A1LMNAKDM4EHTTRIPK1 | |
| SCHEMBL8635203 | 0.87 | HSP90AA1 (0.35) | ALDH1A1LMNASMN1; SMN2POLBMEN1 | |
| SCHEMBL8634338 | 0.86 | ALDH1A1 (0.38) | ALDH1A1LMNAKDM4EPOLBSNCA | |
| SCHEMBL8635879 | 0.85 | MTNR1A (0.43) | ALDH1A1LMNA | |
| SCHEMBL7768673 | 0.84 | SLC9A1 (0.43) | — | |
| SCHEMBL8633199 | 0.84 | PER2 (0.36) | PER2 | |
| SCHEMBL8635259 | 0.83 | ALDH1A1 (0.38) | ALDH1A1RIPK1KMT2APER2 | |
| SCHEMBL8634504 | 0.81 | FLT1 (0.38) | ALDH1A1LMNAKDM4EMAPTTSHR | |
| SCHEMBL8633074 | 0.81 | CYP3A4 (0.37) | ALDH1A1LMNAHTTMAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1057999-C | 4-Aminobenzoylguanidine derivatives | MERCK PATENT GMBH (DE) | 2000-11-01 | — | — | CN | disclosed |
| US-5739142-A | 4-aminobenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-04-14 | — | — | US | disclosed |
| CN-1138575-A | 4-aminobenzoylguanidine derivatives | MERCK PATENT GMBH (DE) | 1996-12-25 | — | — | CN | disclosed |