Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2752127 | 0.85 | IDO1 (0.46) | IDO1GRM5NOTUM | |
| SCHEMBL2751743 | 0.79 | HSP90AA1 (0.44) | HSP90AA1HSP90AB1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2749305 | 0.79 | IDO1 (0.45) | IDO1SMN1; SMN2TP53HPGDALDH1A1 | |
| SCHEMBL2751631 | 0.78 | CYP1A2 (0.37) | CYP2A6SMN1; SMN2LMNATSHR | |
| SCHEMBL3941715 | 0.77 | MEN1 (0.41) | NPC1RAB9ASMN1; SMN2TP53HPGD | |
| SCHEMBL1202032 | 0.76 | IDO1 (0.43) | IDO1NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL12614719 | 0.73 | IDO1 (0.46) | IDO1HSP90AA1HSP90AB1CYP19A1CYP2A6 | |
| SCHEMBL5545804 | 0.72 | CCR1 (0.33) | TP53ALDH1A1TSHR | |
| SCHEMBL1203099 | 0.72 | METAP2 (0.47) | HSP90AA1HSP90AB1CYP19A1NPC1RAB9A | |
| SCHEMBL1436623 | 0.72 | HSD11B1 (0.42) | HSD11B1NOTUMTSHR |
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-2006021848-A1 | ANTI-INFLAMMATORY AGENTS | RANBAXY LABORATORIES LIMITED (IN) | 2006-03-02 | — | — | WO | disclosed |