Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 8/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7064355 | 0.75 | ALDH1A1 (0.56) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL13066508 | 0.74 | ALDH1A1 (0.62) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL3664780 | 0.73 | NPSR1 (0.46) | ALDH1A1ALOX15SMN1; SMN2NAPRTPOLB | |
| SCHEMBL2776583 | 0.73 | ALDH1A1 (0.59) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL30927812 | 0.72 | ALDH1A1 (0.52) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL1046327 | 0.72 | ALDH1A1 (0.52) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL972143 | 0.71 | ALDH1A1 (0.56) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL18158039 | 0.71 | ALDH1A1 (0.56) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL14893324 | 0.71 | ALDH1A1 (0.56) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 | |
| SCHEMBL9163281 | 0.71 | ALDH1A1 (0.56) | ALDH1A1ALOX15SMN1; SMN2KDM4ECA12 |
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-4028112-A | MEROCYANINE DYE WITH OXAZOLE NUCLEUS | FUJI PHOTO FILM CO., LTD. (JA) | 1977-06-07 | — | — | US | disclosed |