Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | FLT3 | P36888 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7796105 | 0.95 | HTR2C (0.48) | TSHRCYP2D6CHEK1TDP1KDM4E | |
| SCHEMBL7794708 | 0.92 | USP2 (0.47) | TSHRCYP2D6CHEK1TDP1KDM4E | |
| SCHEMBL7794711 | 0.92 | KDM4E (0.47) | TSHRCYP2D6CHEK1TDP1KDM4E | |
| SCHEMBL7794778 | 0.92 | MAPK1 (0.50) | TSHRCYP2D6CHEK1KDM4EUSP2 | |
| SCHEMBL7794793 | 0.92 | HTR2C (0.46) | TSHRCYP2D6CHEK1TDP1KDM4E | |
| SCHEMBL7786092 | 0.92 | HTR2C (0.46) | TSHRCYP2D6CHEK1TDP1KDM4E | |
| SCHEMBL7792069 | 0.91 | ALDH1A1 (0.48) | CYP2D6KDM4EALDH1A1SMN1; SMN2HTR2C | |
| Hydrochloric Acid SCHEMBL7786123 | 0.91 | HTR2C (0.45) | TSHRCYP2D6CHEK1TDP1KDM4E | |
| SCHEMBL7795701 | 0.90 | HRH3 (0.49) | CYP2D6KDM4EALDH1A1HTR2CCYP1A2 | |
| SCHEMBL7786149 | 0.89 | HTR2C (0.47) | TSHRCYP2D6CHEK1TDP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0906268-B1 | ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS | AVENTIS PHARMA INC (US) | 2001-11-28 | — | — | EP | disclosed |
| US-6004959-A | HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS | HOECHST MARION ROUSSEL, INC. (US) | 1999-12-21 | — | — | US | disclosed |