Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TOP2A | P11388 | 2/20 | 0.46 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL982923 | 0.85 | TSHR (0.53) | ALDH1A1TSHRRAB9APOLBTOP2A | |
| SCHEMBL19914227 | 0.85 | ALDH1A1 (0.46) | ALDH1A1TDP1TSHRL3MBTL1CYP3A4 | |
| SCHEMBL19914241 | 0.84 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRL3MBTL1CYP3A4 | |
| SCHEMBL19914218 | 0.84 | TDP1 (0.48) | ALDH1A1TDP1TSHRL3MBTL1CYP3A4 | |
| SCHEMBL19914220 | 0.80 | EGLN1 (0.44) | ALDH1A1TDP1TSHRL3MBTL1RAB9A | |
| SCHEMBL19914215 | 0.80 | POLB (0.51) | ALDH1A1TDP1TSHRL3MBTL1CYP3A4 | |
| SCHEMBL1398896 | 0.79 | TOP2A (0.59) | ALDH1A1TSHRRAB9APOLBKMT2A | |
| SCHEMBL496431 | 0.77 | MAOB (0.49) | ALDH1A1TSHRKMT2AMEN1TOP2A | |
| SCHEMBL24162868 | 0.77 | KMT2A (0.67) | ALDH1A1L3MBTL1CYP3A4MAPK1RAB9A | |
| SCHEMBL6840173 | 0.74 | ELANE (0.44) | ALDH1A1POLBKMT2AMEN1TOP2A |
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-2018037223-A1 | ANTIBIOTIC COMPOUNDS | DISCUVA LTD. (GB) | 2018-03-01 | — | — | WO | disclosed |