Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTPRA | P18433 | 1/20 | 0.36 |
| ▸ | PTPRB | P23467 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 4/20 | 0.36 |
| ▸ | METAP1 | P53582 | 3/20 | 0.36 |
| ▸ | GRK6 | P43250 | 1/20 | 0.34 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7735914 | 0.95 | S1PR1 (0.40) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL7736136 | 0.86 | XDH (0.46) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL7858147 | 0.86 | XDH (0.46) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL6462278 | 0.85 | FAAH (0.42) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL7732346 | 0.85 | FAAH (0.42) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL5431040 | 0.85 | FAAH (0.42) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL7561710 | 0.85 | FAAH (0.42) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL7730784 | 0.83 | METAP2 (0.40) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL7730692 | 0.83 | CTSL (0.42) | HSD17B10NPC1CYP1A2CYP3A4RAB9A | |
| SCHEMBL7729637 | 0.82 | METAP2 (0.41) | HSD17B10NPC1CYP1A2CYP3A4RAB9A |
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 |