Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | PKM | P14618 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | APOBEC3A | P31941 | 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 | |
|---|---|---|---|---|
| SCHEMBL14155437 | 0.81 | POLB (0.43) | ALDH1A1MAPTHTTHPGDLMNA | |
| SCHEMBL15514824 | 0.80 | POLB (0.60) | ALDH1A1PKMMAPTKDM4EHTT | |
| SCHEMBL6603361 | 0.79 | POLB (0.46) | ALDH1A1MAPTHTTHPGDLMNA | |
| SCHEMBL16106449 | 0.78 | KMT2A (0.49) | ALDH1A1PKMMAPTHTTHPGD | |
| SCHEMBL16106448 | 0.78 | KMT2A (0.49) | ALDH1A1PKMMAPTHTTHPGD | |
| SCHEMBL16106219 | 0.78 | CTSD (0.44) | ALDH1A1MAPTKDM4EHTTHPGD | |
| SCHEMBL4948393 | 0.78 | HPGD (0.38) | ALDH1A1MAPTHTTHPGDPDE7A | |
| SCHEMBL1303020 | 0.74 | ALDH1A1 (0.46) | ALDH1A1PKMMAPTKDM4EHTT | |
| SCHEMBL689245 | 0.73 | TPMT (0.51) | ALDH1A1PKMMAPTHTTHPGD | |
| SCHEMBL18186633 | 0.73 | MEN1 (0.58) | ALDH1A1KDM4ECYP2C19CYP2C9LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008089034-A2 | CYTOKINE INHIBITORS | KEMIA, INC. (US) | 2008-07-24 | — | — | WO | disclosed |