Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11872916 | 0.81 | TDP1 (0.59) | L3MBTL1TDP1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL5460845 | 0.80 | TDP1 (0.57) | L3MBTL1TDP1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL17336305 | 0.79 | TDP1 (0.65) | L3MBTL1TDP1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL3633747 | 0.79 | CA12 (0.57) | L3MBTL1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL3631412 | 0.79 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1KMT2ALMNA | |
| SCHEMBL20185133 | 0.77 | L3MBTL1 (0.57) | L3MBTL1TDP1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL4099366 | 0.76 | TDP1 (0.50) | L3MBTL1TDP1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL8477526 | 0.76 | TDP1 (0.60) | L3MBTL1TDP1TSHRALDH1A1PTPN1 | |
| SCHEMBL8477522 | 0.76 | TDP1 (0.60) | L3MBTL1TDP1TSHRALDH1A1PLK1 | |
| SCHEMBL6949395 | 0.76 | PTPN1 (0.48) | L3MBTL1TSHRSMN1; SMN2ALDH1A1MEN1 |
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-2150534-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. Lundbeck A/S (DK) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008131779-A1 | ISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2008-11-06 | — | — | WO | disclosed |