Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.68 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.51 |
| ▸ | CTSV | O60911 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1421536 | 0.93 | APP (0.68) | APPNPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL11647126 | 0.90 | APP (0.56) | APPNPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL31375355 | 0.90 | APP (0.56) | APPNPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL743015 | 0.85 | APP (0.61) | APPNPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL6881536 | 0.81 | BCHE (0.63) | APPNPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL12772071 | 0.81 | MAOB (0.62) | NPC1RAB9AHPGDSMN1; SMN2MEN1 | |
| SCHEMBL688463 | 0.81 | FFAR4 (0.56) | APPSMN1; SMN2HTTMAPT | |
| SCHEMBL18623122 | 0.81 | MAOB (0.62) | NPC1RAB9AHPGDSMN1; SMN2MEN1 | |
| SCHEMBL5237170 | 0.81 | APP (0.56) | APPSMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL16256480 | 0.81 | MAPT (0.53) | APPSMN1; SMN2HTR1AADRA1DADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101090909-A | Antibacterial amide macrocycles IV | AICURIS GMBH & CO KG (DE) | 2007-12-19 | — | — | CN | disclosed |
| WO-2004069774-A2 | SYNTHESIS OF 13C-LABELLED ESTROGEN ANALOGUES | THE UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) | 2004-08-19 | — | — | WO | disclosed |