Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | LTC4S | Q16873 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7579004 | 0.81 | ALDH1A1 (0.49) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL6229771 | 0.80 | ALDH1A1 (0.48) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL8197938 | 0.78 | TSHR (0.52) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL6805540 | 0.77 | ALDH1A1 (0.45) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL6804222 | 0.76 | ALDH1A1 (0.42) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL7751110 | 0.74 | ALDH1A1 (0.54) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL6963003 | 0.74 | ALDH1A1 (0.54) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL8197608 | 0.73 | RAB9A (0.56) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL30557772 | 0.72 | ALDH1A1 (0.48) | ALDH1A1RAB9ANPC1POLBLMNA | |
| SCHEMBL7749825 | 0.72 | ALDH1A1 (0.48) | ALDH1A1RAB9ANPC1POLBLMNA |
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-1194427-B1 | THIOPHENE-ETHYL THIOUREA COMPOUNDS AND USE IN THE TREATMENT OF HIV | PARKER HUGHES INST (US) | 2003-03-05 | — | — | EP | disclosed |
| US-6124324-A | AN ENZYME INHIBITOR OF REVERSE TRANSCRIPTASE FOR THE TREATMENT OF HIV INFECTION, INCLUDING MUTANT, DRUG-SENSITIVE, DRUG-RESISTANT, AND MULTI-DRUG RESISTANT STRAINS OF HIV | HUGHES INSTITUTE (US) | 2000-09-26 | — | — | US | disclosed |