Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9416753 | 0.91 | ALDH1A1 (0.49) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL9416757 | 0.84 | GAA (0.44) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL9416778 | 0.84 | ALDH1A1 (0.46) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL26862448 | 0.73 | ALDH1A1 (0.45) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL18663359 | 0.72 | ALDH1A1 (0.43) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL26792532 | 0.72 | ALDH1A1 (0.48) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL19690389 | 0.71 | SMN1; SMN2 (0.40) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| Diethyl Pyrocarbonate SCHEMBL27970756 | 0.71 | SOAT1 (0.62) | ALDH1A1GAAMAPTRAB9ANPC1 | |
| SCHEMBL8179048 | 0.71 | OPRK1 (0.49) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL26862446 | 0.71 | OPRM1 (0.48) | ALDH1A1HPGDGAAMAPTSMN1; 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-5123951-A | Ethylene response inducing agent and malonic acid derivative | RHONE-POULENC NEDERLAND B.V. (NL) | 1992-06-23 | — | — | US | disclosed |