Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.42 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL9912406 | 0.91 | ALDH1A1 (0.43) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL861029 | 0.88 | ALDH1A1 (0.40) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL9912400 | 0.87 | ALDH1A1 (0.42) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL9612036 | 0.85 | ALDH1A1 (0.47) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL9612064 | 0.84 | ALDH1A1 (0.46) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL9612020 | 0.83 | ALDH1A1 (0.45) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL13064283 | 0.82 | ALDH1A1 (0.43) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL13064238 | 0.82 | ALDH1A1 (0.42) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL13064243 | 0.80 | ALDH1A1 (0.42) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA | |
| SCHEMBL9612033 | 0.78 | CYP2C9 (0.47) | ALDH1A1APOBEC3AAPOBEC3GGAALMNA |
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-8198458-B2 | Non-nucleoside reverse transcriptase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-12 | — | — | US | disclosed |
| US-7517998-B2 | Benzothiazole or benzothiazine derivative of dipyrido(2,3;b:2',3'-e) diazepin-6-one; viricide against human t-cell leukemia/lymphoma virus | BOEHRINGER INGELHEIM INTERNATIONAL GMBH | 2009-04-14 | — | — | US | disclosed |