Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9701840 | 0.80 | PRSS1 (0.46) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| SCHEMBL9703262 | 0.80 | KMT2A (0.45) | ALDH1A1CYP1A2KMT2APKMMEN1 | |
| SCHEMBL9703287 | 0.79 | CA1 (0.46) | ALDH1A1CES2CES1SMN1; SMN2GSK3B | |
| SCHEMBL28776057 | 0.76 | ALDH1A1 (0.42) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| SCHEMBL9700906 | 0.72 | EGFR (0.43) | ALDH1A1LMNATAAR1KMT2AMEN1 | |
| SCHEMBL16085822 | 0.71 | ALDH1A1 (0.42) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| SCHEMBL9701638 | 0.68 | EGFR (0.38) | TAAR1 | |
| SCHEMBL21917489 | 0.68 | CYP19A1 (0.41) | ALDH1A1LMNACYP1A2GAANPC1 | |
| SCHEMBL4385605 | 0.67 | GSK3B (0.61) | ALDH1A1LMNACES2CES1SMN1; SMN2 | |
| SCHEMBL25910898 | 0.67 | ALDH1A1 (0.42) | ALDH1A1LMNACES2CES1SMN1; SMN2 |
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-5120764-A | Administering penicillamine and allenylamines to inhibit crosslinking of collagen | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-06-09 | — | — | US | claimed |