Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | HTT | P42858 | 1/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.63 |
| ▸ | MAOB | P27338 | 2/20 | 0.62 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.57 |
| ▸ | BCHE | P06276 | 3/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | AGXT | P21549 | 2/20 | 0.53 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9416628 | 0.90 | KDM4E (0.79) | KDM4EALDH1A1HTTSMN1; SMN2HDAC1 | |
| SCHEMBL1134127 | 0.89 | CHRM2 (0.74) | KDM4EALDH1A1HTTSMN1; SMN2HDAC1 | |
| SCHEMBL30245831 | 0.88 | KDM4E (0.77) | KDM4EALDH1A1HTTSMN1; SMN2HDAC1 | |
| SCHEMBL8880839 | 0.88 | KDM4E (0.77) | KDM4EALDH1A1HTTSMN1; SMN2HDAC1 | |
| Hydrochloric Acid SCHEMBL6122475 | 0.88 | CHRM2 (0.72) | KDM4EALDH1A1HTTSMN1; SMN2HDAC1 | |
| SCHEMBL29947713 | 0.84 | TAAR1 (0.71) | ALDH1A1MAOBCHRM2TAAR1IDO1 | |
| SCHEMBL42954 | 0.84 | TAAR1 (0.71) | ALDH1A1MAOBCHRM2TAAR1IDO1 | |
| SCHEMBL4584077 | 0.83 | CHRM2 (0.77) | KDM4EALDH1A1HTTSMN1; SMN2CHRM2 | |
| SCHEMBL24343795 | 0.83 | ALDH1A1 (0.61) | KDM4EALDH1A1HTTSMN1; SMN2HDAC1 | |
| SCHEMBL18635836 | 0.83 | HDAC1 (0.68) | KDM4EALDH1A1HTTSMN1; SMN2HDAC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6512000-B1 | Aminocarbonyl- substituted benzimidazole derivatives for the treatment of diseases in which inhibition of tryptase is of therapeutic such as for treating an inflammatory or allergic disease | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2003-01-28 | — | — | US | disclosed |