Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5806059 | 0.88 | TSHR (0.39) | TSHRALDH1A1CHRNB4CHRNA3 | |
| SCHEMBL5815231 | 0.81 | ACKR3 (0.40) | ALDH1A1 | |
| SCHEMBL5803808 | 0.81 | TSHR (0.42) | TSHRALDH1A1CHRNB4CHRNA3CES2 | |
| SCHEMBL8113614 | 0.76 | GAPDH (0.52) | ALDH1A1CHRNB4CHRNA3SMN1; SMN2MAPT | |
| SCHEMBL5806578 | 0.74 | HTR1A (0.56) | — | |
| SCHEMBL27714387 | 0.73 | CHRNB4 (0.43) | ALDH1A1CHRNB4CHRNA3 | |
| SCHEMBL6810224 | 0.69 | AR (0.41) | ALDH1A1CHRNB4CHRNA3SMN1; SMN2LMNA | |
| SCHEMBL27596768 | 0.69 | CHRNB4 (0.49) | ALDH1A1CHRNB4CHRNA3SMN1; SMN2MAPT | |
| SCHEMBL27821121 | 0.68 | CHRNB4 (0.46) | CHRNB4CHRNA3 | |
| SCHEMBL15544368 | 0.68 | ALDH1A1 (0.44) | ALDH1A1CHRNB4CHRNA3SMN1; SMN2POLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006088954-A1 | DIHYDROINDOLYL METHANONES AS ALPHA 1A/1D ADRENORECEPTOR MODULATORS FOR THE TREATMENT OF BENIGN PROSTATIC HYPERTROPHY AND LOWER URINARY TRACT SYMPTOMS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2006-08-24 | — | — | WO | disclosed |