Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | HTR1F | P30939 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | TKT | P29401 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8781884 | 0.73 | CYP1A2 (0.38) | CYP1A2ADORA3KDM4EPOLBADORA1 | |
| SCHEMBL6694707 | 0.70 | CDK2 (0.46) | CYP1A2FGFR1KDM4ECYP2C9CYP2C19 | |
| SCHEMBL8883709 | 0.70 | MAPK8 (0.37) | CYP1A2TDP1ADORA3KDM4EPOLB | |
| SCHEMBL31412961 | 0.66 | ROCK2 (0.47) | HTR1AHTR1DHTR1BHTR1FCYP1A2 | |
| SCHEMBL944470 | 0.65 | LMNA (0.44) | HTR1AHTR1DHTR1BHTR1FCYP1A2 | |
| SCHEMBL536840 | 0.65 | L3MBTL1 (0.40) | KDM4ELMNAGDAL3MBTL1 | |
| SCHEMBL1603869 | 0.65 | L3MBTL1 (0.56) | CYP1A2ADORA3KDM4EPOLBGAA | |
| SCHEMBL8175532 | 0.64 | CYP1A2 (0.41) | HTR1AHTR1DHTR1BHTR1FCYP1A2 | |
| SCHEMBL5694090 | 0.64 | GDA (0.46) | HTR1AHTR1DHTR1BHTR1FCYP1A2 | |
| SCHEMBL10997056 | 0.64 | CYP1A2 (0.41) | HTR1AHTR1DHTR1BHTR1FCYP1A2 |
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-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 |