Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL9737888 | 0.80 | SMO (0.40) | ALDH1A1POLBMAPTSMN1; SMN2CYP2C9 | |
| SCHEMBL9739181 | 0.73 | ALDH1A1 (0.37) | ALDH1A1LMNAMAPTGAANPC1 | |
| SCHEMBL9376913 | 0.68 | SMO (0.36) | ALDH1A1HTTPOLBLMNAMAPT | |
| SCHEMBL10918542 | 0.68 | TSHR (0.71) | CYP19A1TSHRALDH1A1HTTPOLB | |
| SCHEMBL4605520 | 0.65 | TSHR (0.50) | CYP19A1TSHRADORA2AALDH1A1HTT | |
| SCHEMBL1822105 | 0.64 | TSHR (0.49) | CYP19A1TSHRADORA2AALDH1A1HTT | |
| SCHEMBL5462604 | 0.64 | CYP19A1 (0.50) | CYP19A1TSHRALDH1A1HTTPOLB | |
| SCHEMBL29864638 | 0.64 | TSHR (0.65) | CYP19A1TSHRALDH1A1LMNAMAPT | |
| SCHEMBL5250015 | 0.64 | TSHR (0.65) | CYP19A1TSHRALDH1A1LMNAMAPT | |
| SCHEMBL21803734 | 0.63 | CYP19A1 (0.57) | CYP19A1TSHRADORA2AALDH1A1HTT |
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-1992006979-A1 | NEW DIAZINES | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1992-04-30 | — | — | WO | disclosed |