Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RBP4 | P02753 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.42 |
| ▸ | FAAH | O00519 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3721450 | 0.78 | TAS1R3 (0.46) | TP53SMN1; SMN2HTTMAPTKDM4E | |
| SCHEMBL3713712 | 0.73 | LIMK2 (0.42) | NPC1TP53RAB9ASMN1; SMN2TSHR | |
| SCHEMBL1821178 | 0.70 | SMN1; SMN2 (0.54) | NPC1RAB9ASMN1; SMN2HTTCYP2C9 | |
| SCHEMBL7890248 | 0.69 | POLB (0.66) | NPC1TP53RAB9ASMN1; SMN2TSHR | |
| SCHEMBL31596964 | 0.68 | NPC1 (0.55) | NPC1TP53RAB9ASMN1; SMN2TSHR | |
| SCHEMBL3714521 | 0.68 | KDM4E (0.55) | NPC1TP53RAB9ASMN1; SMN2TSHR | |
| SCHEMBL11833345 | 0.68 | LMNA (0.79) | NPC1TP53RAB9ASMN1; SMN2TSHR | |
| SCHEMBL10729724 | 0.68 | KDM4E (0.77) | SMN1; SMN2HTTMAPTKDM4EALDH1A1 | |
| SCHEMBL2897923 | 0.68 | KDM4E (0.77) | SMN1; SMN2HTTMAPTKDM4EALDH1A1 | |
| SCHEMBL7888115 | 0.67 | RBP4 (0.52) | NPC1TP53RAB9ASMN1; SMN2TSHR |
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-2010102663-A1 | PIPERAZINE DERIVATIVES FOR USE IN THERAPY | GLAXO GROUP LIMITED (GB) | 2010-09-16 | — | — | WO | disclosed |