Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UNG | P13051 | 5/20 | 0.53 |
| ▸ | THRA | P10827 | 3/20 | 0.48 |
| ▸ | THRB | P10828 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | TACR2 | P21452 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | SHBG | P04278 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13856898 | 1.00 | UNG (0.53) | UNGTHRATHRBCA2CA12 | |
| SCHEMBL29699621 | 0.98 | UNG (0.51) | UNGTHRATHRBCA2CA12 | |
| SCHEMBL1476038 | 0.94 | HPGD (0.50) | UNGCA2CA12CA1CA9 | |
| SCHEMBL14489853 | 0.90 | NPC1 (0.60) | UNGTHRATHRBLMNAHIF1A | |
| SCHEMBL9438202 | 0.87 | BACE1 (0.49) | UNGLMNATP53HSD17B10MEN1 | |
| SCHEMBL31150829 | 0.86 | UNG (0.47) | UNGTHRATHRBCA2CA12 | |
| SCHEMBL28524139 | 0.86 | RAB9A (0.55) | UNGTHRATHRBLMNAHIF1A | |
| SCHEMBL28525824 | 0.86 | RAB9A (0.55) | UNGTHRATHRBLMNAHIF1A | |
| SCHEMBL9129626 | 0.85 | NPC1 (0.61) | UNGCA2CA12CA1CA9 | |
| SCHEMBL10732288 | 0.84 | NPC1 (0.62) | LMNATP53HIF1AHSD17B10MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20090006004-A1 | Method for Determining the Identity, Absence and Concentration of a Chemical Compound in a Medium | BASF SE (DE) | 2009-01-01 | — | — | US | disclosed |
| US-20080057589-A1 | Method For Determining The Presence Of A Chemical Compound Which Is Homogeneously Distributed In A Medium By Means Of Cross-Correlating A Measuring Spectrum With Reference Spectra | BASF AKTIENGESELLSCHAFT (DE) | 2008-03-06 | — | — | US | disclosed |
| US-20070149415-A1 | Power and lubricant additive concentrates containing at least one anthrachinone derivative as a marking substance | BASF AKTIENGESELLSCHAFT (DE) | 2007-06-28 | — | — | US | disclosed |