Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.68 |
| ▸ | RAB9A | P51151 | 4/20 | 0.68 |
| ▸ | MTOR | P42345 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.57 |
| ▸ | USP2 | O75604 | 4/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.55 |
| ▸ | HPGDS | O60760 | 6/20 | 0.55 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.51 |
| ▸ | NAMPT | P43490 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1535706 | 0.80 | LMNA (0.63) | NPC1RAB9ACYP3A4CYP1A2SMN1; SMN2 | |
| SCHEMBL3087846 | 0.77 | HPGDS (0.78) | NPC1RAB9ACYP3A4USP2CYP1A2 | |
| SCHEMBL3092005 | 0.77 | SMN1; SMN2 (0.65) | NPC1RAB9ACYP3A4USP2CYP1A2 | |
| SCHEMBL20804546 | 0.75 | SMN1; SMN2 (0.90) | USP2SMN1; SMN2KDM4ETSHRMAPK1 | |
| SCHEMBL13148296 | 0.75 | HPGDS (0.80) | CYP3A4USP2CYP1A2SMN1; SMN2HPGDS | |
| SCHEMBL22183197 | 0.73 | SMN1; SMN2 (0.60) | NPC1RAB9ACYP3A4CYP1A2SMN1; SMN2 | |
| SCHEMBL30933628 | 0.73 | MTOR (1.00) | NPC1RAB9AMTORCYP3A4CYP1A2 | |
| SCHEMBL17706589 | 0.73 | KDM4E (0.70) | NPC1RAB9ASMN1; SMN2KDM4ETP53 | |
| SCHEMBL13148152 | 0.73 | CYP3A4 (0.71) | NPC1RAB9ACYP3A4USP2CYP1A2 | |
| SCHEMBL31065708 | 0.72 | SMN1; SMN2 (0.90) | SMN1; SMN2MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2150532-A1 | PIPERAZINE COMPOUNDS FOR THE INHIBITION OF HAEMATOPOIETIC PROSTAGLANDIN D SYNTHASE | Evotec AG (DE) | 2010-02-10 | — | — | EP | claimed |
| WO-2008122787-A1 | PIPERAZINE COMPOUNDS FOR THE INHIBITION OF HAEMATOPOIETIC PROSTAGLANDIN D SYNTHASE | EVOTEC AG (DE) | 2008-10-16 | — | — | WO | claimed |