Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.67 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | KIF11 | P52732 | 3/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.47 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.47 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.47 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
| ▸ | KCNJ6 | P48051 | 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 | |
|---|---|---|---|---|
| SCHEMBL28035878 | 0.84 | HTR2A (0.53) | TRPV4HTR2AHTR2CALDH1A1KIF11 | |
| SCHEMBL23536128 | 0.82 | LMNA (0.52) | TRPV4HTR2AHTR2CALDH1A1LMNA | |
| SCHEMBL28141663 | 0.81 | HTR2A (0.50) | TRPV4HTR2AHTR2CALDH1A1LMNA | |
| SCHEMBL24961917 | 0.81 | NR1H3 (0.68) | TRPV4ALDH1A1SMN1; SMN2ABCC9ABCC8 | |
| SCHEMBL23536256 | 0.81 | ABCC9 (0.54) | TRPV4ALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL4409342 | 0.81 | ALDH1A1 (0.57) | TRPV4HTR2AHTR2CALDH1A1LMNA | |
| SCHEMBL28035458 | 0.79 | HTT (0.63) | HTR2AHTR2CALDH1A1LMNAHTT | |
| SCHEMBL16508752 | 0.78 | HTR2A (0.48) | TRPV4HTR2AHTR2CALDH1A1LMNA | |
| SCHEMBL19185561 | 0.78 | ALDH1A1 (0.52) | TRPV4HTR2AHTR2CALDH1A1LMNA | |
| SCHEMBL14635095 | 0.77 | MAPT (0.56) | TRPV4ALDH1A1LMNAHTTSMN1; SMN2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106928197-A | Trk inhibiting compounds | 小野药品工业株式会社 | 2017-07-07 | — | — | CN | claimed |
| CN-104995172-A | Trk inhibiting compounds | ONO PHARMACEUTICAL CO | 2015-10-21 | — | — | CN | claimed |
| CN-117535689-A | Method for synthesizing sulfonamide through decarbonylation of N, N-dimethylformamide and denitrification of sulfonyl hydrazide under electrochemical condition | 湘潭大学 | 2024-02-09 | — | — | CN | disclosed |
| CN-106986857-B | Trk inhibiting compound | 小野药品工业株式会社 | 2019-07-05 | — | — | CN | disclosed |
| CN-106986857-A | Trk inhibiting compounds | 小野药品工业株式会社 | 2017-07-28 | — | — | CN | disclosed |
| CN-106928197-A | Trk inhibiting compounds | 小野药品工业株式会社 | 2017-07-07 | — | — | CN | disclosed |
| CN-104995172-B | Trk inhibiting compounds | 小野药品工业株式会社 | 2017-05-31 | — | — | CN | disclosed |
| CN-104995172-A | Trk inhibiting compounds | ONO PHARMACEUTICAL CO | 2015-10-21 | — | — | CN | disclosed |
| WO-2012142457-A2 | MACROLACTAM COMPOUNDS AND METHODS FOR THE TREATMENT OF MALARIA | THE BROAD INSTITUTE, INC. (US) | 2012-10-18 | — | — | WO | disclosed |