Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.37 |
| ▸ | EDNRB | P24530 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29564376 | 0.87 | ALDH1A1 (0.40) | NPC1RAB9AKMT2ACYP3A4TDP1 | |
| SCHEMBL20917122 | 0.87 | ALDH1A1 (0.40) | NPC1RAB9AKMT2ACYP3A4TDP1 | |
| SCHEMBL14877956 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL20201647 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL12926846 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL2774865 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL19817592 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL12240207 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL14267126 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL19649023 | 0.85 | HSD17B1 (0.43) | NPC1RAB9AMEN1KMT2ACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5747205-A | STARBURST AROMATIC AMINES | XEROX CORPORATION (US) | 1998-05-05 | — | — | US | claimed |
| US-5891587-A | ORGANIC ELECTROLUMINESCENT DEVICE COMPRISED OF ANODE, CATHODE, STARBURST AROMATIC AMINE COMPOUND | XEROX CORPORATION (US) | 1999-04-06 | — | — | US | disclosed |
| US-5747205-A | STARBURST AROMATIC AMINES | XEROX CORPORATION (US) | 1998-05-05 | — | — | US | disclosed |