Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 2/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.38 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.38 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.38 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8781880 | 0.77 | CYP1A2 (0.40) | CYP1A2KMT2AALDH1A1MAPTADORA3 | |
| SCHEMBL7807597 | 0.76 | CYP1A2 (0.39) | CYP1A2KMT2AALDH1A1ADORA3POLB | |
| SCHEMBL9640561 | 0.68 | CYP1A2 (0.66) | MAPK8PRKD3MAP4K4MAPK9MAPK10 | |
| SCHEMBL8886484 | 0.68 | CYP1A2 (0.37) | CYP1A2TDP1LMNAADORA3POLB | |
| SCHEMBL19186680 | 0.67 | CDK1 (0.41) | MAPK8PRKD3MAP4K4MAPK9MAPK10 | |
| SCHEMBL16834106 | 0.66 | KDM4E (0.33) | CYP1A2MAPTPOLBKDM4EHPGD | |
| SCHEMBL4119354 | 0.66 | MAPK8 (0.40) | MAPK8PRKD3MAP4K4MAPK9MAPK10 | |
| SCHEMBL8883709 | 0.66 | MAPK8 (0.37) | MAPK8PRKD3MAP4K4MAPK9MAPK10 | |
| SCHEMBL15781042 | 0.64 | CDK5 (0.49) | TDP1MAPTKDM4E | |
| SCHEMBL3331750 | 0.63 | TTK (0.48) | MAPK8MAPK10CYP1A2TDP1MEN1 |
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-5631259-A | PURINE BASE DERIVATIVES FOR NUCLEOSIDES | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-20 | — | — | US | claimed |
| US-5631259-A | PURINE BASE DERIVATIVES FOR NUCLEOSIDES | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-20 | — | — | US | disclosed |
| EP-0521463-A2 | Substituted cyclic cycloalkyltriols, process, intermediates for their preparation and their use as antiviral and antiparasitic agents | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-01-07 | — | — | EP | disclosed |