Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | KIT | P10721 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL11326119 | 0.73 | AR (0.39) | ALDH1A1SMN1; SMN2BRD4CREBBPKDM4E | |
| SCHEMBL6537392 | 0.71 | MAPT (0.36) | ALDH1A1SMN1; SMN2LMNAHPGDHTT | |
| SCHEMBL24725924 | 0.70 | MRGPRX2 (0.40) | BRD4CREBBPSIGMAR1 | |
| SCHEMBL6539867 | 0.70 | AR (0.38) | BRD4LMNASIGMAR1 | |
| Bromide SCHEMBL6028566 | 0.69 | PGR (0.41) | ALDH1A1SMN1; SMN2KDM4ELMNAHPGD | |
| SCHEMBL9176307 | 0.69 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7092850 | 0.68 | SNCA (0.43) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL11371183 | 0.68 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2KDM4ELMNAHPGD | |
| SCHEMBL30403926 | 0.68 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2BRD4CREBBPPDPK1 | |
| SCHEMBL27591208 | 0.67 | PDPK1 (0.59) | ALDH1A1BRD4PDPK1CA12CA1 |
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-4145537-A | BENZOTHIAZOLIUM DYES | BAYER AKTIENGESELLSCHAFT (DE) | 1979-03-20 | — | — | US | disclosed |