Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | RBP4 | P02753 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6898814 | 0.88 | CYP3A4 (0.42) | ALDH1A1LMNAMAPTNPSR1CYP3A4 | |
| SCHEMBL6898372 | 0.87 | CYP3A4 (0.47) | ALDH1A1LMNAMAPTCYP3A4CYP2C19 | |
| SCHEMBL6899041 | 0.85 | CYP3A4 (0.52) | ALDH1A1LMNAMAPTNPSR1CYP3A4 | |
| SCHEMBL6897563 | 0.85 | KMT2A (0.52) | ALDH1A1LMNAMAPTCYP3A4CYP2C19 | |
| SCHEMBL6966587 | 0.84 | RBP4 (0.52) | ALDH1A1LMNAMAPTNPSR1KDM4E | |
| SCHEMBL6782920 | 0.84 | KMT2A (0.53) | ALDH1A1LMNAMAPTCYP3A4CYP2C19 | |
| SCHEMBL6894906 | 0.83 | P2RX7 (0.36) | ALDH1A1LMNAMAPTNPSR1CYP3A4 | |
| SCHEMBL6896729 | 0.81 | KMT2A (0.52) | ALDH1A1LMNAMAPTNPSR1KDM4E | |
| SCHEMBL6897989 | 0.81 | KMT2A (0.41) | ALDH1A1LMNAMAPTCYP3A4CYP2C19 | |
| SCHEMBL6897464 | 0.78 | CYP3A4 (0.42) | ALDH1A1LMNAMAPTNPSR1CYP3A4 |
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-6683184-B2 | ANTITUMOR AGENTS | SAMJIN PHARMACEUTICAL CO., LTD. (KR) | 2004-01-27 | — | — | US | disclosed |