Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 9/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11433779 | 0.90 | NPC1 (0.47) | NPC1RAB9AL3MBTL1CYP19A1CYP17A1 | |
| SCHEMBL10900702 | 0.79 | TRPV1 (0.41) | CYP19A1CYP17A1CYP3A4TRPV1CYP3A5 | |
| SCHEMBL11439269 | 0.78 | CYP3A4 (0.51) | NPC1RAB9AL3MBTL1CYP19A1CYP3A4 | |
| Sulfuric Acid SCHEMBL11445544 | 0.78 | NPC1 (0.37) | NPC1RAB9AL3MBTL1CYP19A1CYP3A4 | |
| SCHEMBL11442557 | 0.72 | NPC1 (0.50) | NPC1RAB9AL3MBTL1CYP19A1TRPV1 | |
| SCHEMBL11439287 | 0.72 | NPC1 (0.47) | NPC1RAB9AL3MBTL1CYP19A1CYP3A4 | |
| SCHEMBL11431939 | 0.70 | CYP3A4 (0.57) | NPC1RAB9ACYP17A1CYP3A4CYP3A5 | |
| SCHEMBL20148788 | 0.68 | SMN1; SMN2 (0.47) | RAB9AL3MBTL1CYP19A1CYP17A1CYP3A4 | |
| SCHEMBL7189416 | 0.68 | CYP3A4 (0.42) | CYP19A1CYP17A1CYP3A4CYP3A5ABL1 | |
| SCHEMBL69378 | 0.68 | CYP3A4 (0.42) | CYP19A1CYP17A1CYP3A4CYP3A5ABL1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4194899-A | HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS | ELI LILLY AND COMPANY (US) | 1980-03-25 | — | — | US | claimed |
| US-4194899-A | HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS | ELI LILLY AND COMPANY (US) | 1980-03-25 | — | — | US | disclosed |
| US-4110099-A | INHIBITOR FOR INTERNODEL GROWTH OF PLANTS | ELI LILLY AND COMPANY (US) | 1978-08-29 | — | — | US | disclosed |
| US-RE29367-E | HERBICIDES, FUNGICIDES, 5-PYRIMIDINYL | ELI LILLY AND COMPANY (US) | 1977-08-23 | — | — | US | disclosed |
| US-4002628-A | HERBICIDES, PLANT FUNGICIDES, PLANT GROWTH REGULATORS | ELI LILLY AND COMPANY (US) | 1977-01-11 | — | — | US | disclosed |
| US-3967949-A | Fluoroalkoxyphenyl-substituted nitrogen heterocycles as plant stunting agents | ELI LILLY AND COMPANY (US) | 1976-07-06 | — | — | US | disclosed |