Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | CCR3 | P51677 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10068063 | 0.89 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNAKCNH2MCHR1 | |
| SCHEMBL904202 | 0.84 | ALDH1A1 (0.51) | ALDH1A1KDM4ELMNANPSR1HTT | |
| SCHEMBL903886 | 0.83 | KDM4E (0.54) | ALDH1A1KDM4ELMNASMN1; SMN2RECQL | |
| SCHEMBL904002 | 0.83 | KDM4E (0.51) | ALDH1A1KDM4ELMNAICAM1SMN1; SMN2 | |
| SCHEMBL1003970 | 0.83 | ALDH1A1 (0.51) | ALDH1A1KDM4ELMNAKCNH2MCHR1 | |
| SCHEMBL15495062 | 0.81 | CHKA (0.58) | ALDH1A1KDM4ELMNAHTT | |
| SCHEMBL1006389 | 0.80 | KDM4E (0.54) | ALDH1A1KDM4ELMNASMN1; SMN2CCR3 | |
| SCHEMBL940416 | 0.79 | ALDH1A1 (0.62) | ALDH1A1KDM4ENPSR1SMN1; SMN2RECQL | |
| SCHEMBL1005879 | 0.79 | KDM4E (0.62) | ALDH1A1KDM4ELMNANPSR1SMN1; SMN2 | |
| SCHEMBL4694589 | 0.77 | ALDH1A1 (0.72) | ALDH1A1KDM4EHTTSMN1; SMN2ACHE |
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 |
|---|---|---|---|---|---|---|---|
| CN-102432598-A | Tricyclic compound, preparation method thereof and pharmaceutical application thereof | JIANGSU HENGRUI MEDICINE CO | 2012-05-02 | — | — | CN | disclosed |
| WO-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |