Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
| ▸ | BAD | Q92934 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 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 | |
|---|---|---|---|---|
| SCHEMBL8483842 | 0.98 | BCL2L1 (0.50) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| SCHEMBL30306120 | 0.98 | BCL2L1 (0.50) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| SCHEMBL10494159 | 0.82 | PNMT (0.45) | BCL2L1BADTSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL3150959 | 0.82 | BCL2L1 (0.43) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| SCHEMBL9720039 | 0.81 | BCL2L1 (0.54) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| SCHEMBL5753897 | 0.80 | BCL2L1 (0.53) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| SCHEMBL10602990 | 0.80 | PNMT (0.50) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| SCHEMBL9678350 | 0.78 | BCL2L1 (0.42) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| Hydrochloric Acid SCHEMBL10647798 | 0.78 | PNMT (0.49) | BCL2L1BADTSHRTBXA2RALDH1A1 | |
| SCHEMBL10494233 | 0.78 | PNMT (0.45) | BCL2L1BADTSHRALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017132912-A1 | ALKYLAMINE WITH BENZOALICYCLIC SUBSTITUENT AND APPLICATION THEREOF | 华东理工大学 | 2017-08-10 | — | — | WO | disclosed |