Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7733577 | 0.75 | AAK1 (0.45) | AAK1SMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL7729637 | 0.74 | METAP2 (0.41) | SMN1; SMN2KDM4ENPC1RAB9AHSD17B10 | |
| SCHEMBL8059666 | 0.66 | HDAC3 (0.42) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL8136679 | 0.66 | HDAC3 (0.42) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL8060603 | 0.66 | NPC1 (0.42) | NPC1ALDH1A1RAB9AKMT2AMAPT | |
| Hydrochloric Acid SCHEMBL6349192 | 0.65 | HDAC3 (0.41) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL8060536 | 0.65 | RAB9A (0.51) | SMN1; SMN2NPC1ALDH1A1RAB9AKMT2A | |
| SCHEMBL8230300 | 0.64 | NPC1 (0.39) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL8061854 | 0.63 | MAPT (0.46) | NPC1RAB9AMAPT | |
| SCHEMBL12247707 | 0.63 | PTPN1 (0.40) | SMN1; SMN2KDM4ENPC1ALDH1A1HSD17B10 |
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-6436980-B1 | TRANSPORT PROTEIN SUPPRESSORS; MICROBIOCIDES | ESSENTIAL THERAPEUTICS, INC. | 2002-08-20 | — | — | US | disclosed |
| US-6204279-B1 | SECONDARY AMIDE CONTAINING BENZOXAZOLE DERIVATIVES | MICROCIDE PHARMACEUTICALS, INC. | 2001-03-20 | — | — | US | disclosed |