Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | LDHA | P00338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7098750 | 0.81 | NPC1 (0.44) | RAB9ANPC1SMN1; SMN2EPHX2LDHA | |
| SCHEMBL2496332 | 0.76 | CACNA1B (0.41) | RAB9ANPC1SMN1; SMN2EPHX2ALDH1A1 | |
| SCHEMBL6626906 | 0.73 | ALDH1A1 (0.48) | SMN1; SMN2LDHAALDH1A1KMT2ALMNA | |
| SCHEMBL2200899 | 0.72 | ALDH1A1 (0.50) | RAB9ANPC1SMN1; SMN2LDHAALDH1A1 | |
| SCHEMBL8477947 | 0.72 | KCNA5 (0.45) | ALDH1A1KMT2A | |
| SCHEMBL6627416 | 0.72 | ITGB1 (0.47) | RAB9ANPC1SMN1; SMN2EPHX2LDHA | |
| SCHEMBL6215052 | 0.70 | CYP1A2 (0.33) | ALDH1A1CYP1A2 | |
| SCHEMBL3865460 | 0.70 | CYP1A2 (0.33) | ALDH1A1CYP1A2 | |
| SCHEMBL6680402 | 0.70 | CYP1A2 (0.33) | ALDH1A1CYP1A2 | |
| SCHEMBL8355738 | 0.69 | ALDH1A1 (0.47) | RAB9ANPC1SMN1; SMN2LDHAALDH1A1 |
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-8030489-B2 | Ornithine derivative | ASTELLAS PHARMA INC. (JP) | 2011-10-04 | — | — | US | disclosed |