Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.38 |
| ▸ | RAB9A | P51151 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8674456 | 0.81 | ALDH1A1 (0.36) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL8467168 | 0.70 | GAA (0.35) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL8467480 | 0.70 | HDAC3 (0.38) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL451924 | 0.68 | HDAC3 (0.54) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL7938016 | 0.68 | HDAC3 (0.54) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL28641832 | 0.63 | HDAC3 (0.58) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL23493515 | 0.62 | TSHR (0.50) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL3658195 | 0.62 | GAA (0.48) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL10336633 | 0.60 | SMN1; SMN2 (0.46) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL777642 | 0.59 | PTPN1 (0.44) | NPC1RAB9AKMT2AMEN1HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5726333-A | POLYMERIZATION CATALYSTS | HOECHST AG (DE) | 1998-03-10 | — | — | US | disclosed |
| EP-0694557-A2 | Organo metallic compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-01-31 | — | — | EP | disclosed |