Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | AGER | Q15109 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2129407 | 0.84 | SMN1; SMN2 (0.59) | SMN1; SMN2TP53LMNAALDH1A1GAA | |
| SCHEMBL258223 | 0.83 | ALDH1A1 (0.55) | SMN1; SMN2LMNAALDH1A1GAAKDM4E | |
| SCHEMBL12984306 | 0.82 | KCNK2 (0.46) | SMN1; SMN2TP53LMNAALDH1A1GAA | |
| SCHEMBL15738996 | 0.81 | KMT2A (0.53) | SMN1; SMN2TP53LMNAALDH1A1KDM4E | |
| SCHEMBL2750299 | 0.77 | KDM5A (0.51) | SMN1; SMN2LMNAALDH1A1KDM4ETDP1 | |
| Lactic Acid SCHEMBL810781 | 0.77 | ALDH1A1 (0.47) | SMN1; SMN2TP53LMNAALDH1A1GAA | |
| Salicylic Acid SCHEMBL810603 | 0.77 | ALDH1A1 (0.56) | SMN1; SMN2LMNAALDH1A1KDM4ETDP1 | |
| SCHEMBL9869479 | 0.77 | L3MBTL1 (0.47) | SMN1; SMN2TP53LMNAALDH1A1GAA | |
| SCHEMBL123202 | 0.76 | KDM4E (0.57) | SMN1; SMN2TP53LMNAALDH1A1GAA | |
| SCHEMBL2129607 | 0.76 | L3MBTL1 (0.49) | SMN1; SMN2LMNAALDH1A1KDM4ETDP1 |
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-2005009966-A1 | NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS | PFIZER LIMITED (GB) | 2005-02-03 | — | — | WO | disclosed |