Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | GALR2 | O43603 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7006546 | 0.83 | TSHR (0.48) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| SCHEMBL29760183 | 0.83 | TSHR (0.48) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| SCHEMBL15580573 | 0.83 | TSHR (0.39) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| SCHEMBL25337052 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| SCHEMBL31597058 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| SCHEMBL16653830 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| Ammonia Solution, Strong SCHEMBL25335787 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| SCHEMBL12913220 | 0.79 | GPR35 (0.44) | ALDH1A1TSHRCYP3A4PARP1LMNA | |
| SCHEMBL27831883 | 0.76 | TSHR (0.47) | ALDH1A1TSHRCYP3A4RECQLGAA | |
| SCHEMBL3790793 | 0.75 | ALDH1A1 (0.39) | ALDH1A1TSHRCYP3A4PARP1LMNA |
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-2017132474-A1 | BCL-2 INHIBITORS | NEWAVE PHARMACEUTICAL INC. (US) | 2017-08-03 | — | — | WO | disclosed |