Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.43 |
| ▸ | BCR | P11274 | 2/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 11/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1710259 | 0.84 | ALDH1A1 (0.57) | ABL1BCRPIN1ALDH1A1MAPK1 | |
| SCHEMBL3561849 | 0.82 | CYP1A2 (0.55) | ABL1BCRALDH1A1MAPK1MAPT | |
| SCHEMBL3537856 | 0.80 | MAPT (0.48) | ABL1BCRPIN1ALDH1A1MAPK1 | |
| SCHEMBL11825995 | 0.78 | MAPT (0.38) | ALDH1A1MAPK1MAPTPOLBTDP1 | |
| SCHEMBL11820403 | 0.77 | SMN1; SMN2 (0.63) | ABL1BCRALDH1A1MAPK1MAPT | |
| SCHEMBL11835596 | 0.74 | SMN1; SMN2 (0.40) | ABL1BCRMAPTPOLBSMN1; SMN2 | |
| SCHEMBL26590315 | 0.72 | ALDH1A1 (0.51) | ABL1BCRALDH1A1MAPK1MAPT | |
| SCHEMBL11823309 | 0.72 | ALDH1A1 (0.46) | ALDH1A1MAPK1MAPTPOLBHTT | |
| SCHEMBL6628480 | 0.72 | MAPT (0.52) | ABL1BCRALDH1A1MAPK1MAPT | |
| SCHEMBL1917902 | 0.71 | PRKCQ (0.52) | CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-3975384-A | ANTITHROMBOTICS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-08-17 | — | — | US | disclosed |