Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 1.00 |
| ▸ | CES2 | O00748 | 1/20 | 0.68 |
| ▸ | CES1 | P23141 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 3/20 | 0.60 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.55 |
| ▸ | FEN1 | P39748 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.54 |
| ▸ | CA4 | P22748 | 1/20 | 0.54 |
| ▸ | CA6 | P23280 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL29004189 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL29369803 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL29518925 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL367 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL6915337 | 0.97 | ALDH1A1 (0.95) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL8612015 | 0.97 | ALDH1A1 (0.95) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL2059640 | 0.97 | ALDH1A1 (0.95) | ALDH1A1CES2CES1TSHRALOX15 | |
| Fluoride SCHEMBL6444932 | 0.97 | ALDH1A1 (0.95) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL11768054 | 0.97 | ALDH1A1 (0.95) | ALDH1A1CES2CES1TSHRALOX15 | |
| SCHEMBL6913277 | 0.97 | ALDH1A1 (0.95) | ALDH1A1CES2CES1TSHRALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5944854-A | LEUCO DYES | DYSTAR TEXTILFARBEN GMBH & CO. (DE) | 1999-08-31 | — | — | US | disclosed |
| US-5696258-A | REDUCING TO LEUCO FORM; REOXIDATION | DYSTAR TEXTILFARBEN GMBH (DE) | 1997-12-09 | — | — | US | disclosed |