Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.63 |
| ▸ | NAMPT | P43490 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | FLT4 | P35916 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.40 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.40 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.40 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8918194 | 0.93 | IKBKB (0.53) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| Chs-828 SCHEMBL12083293 | 0.88 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| Chs-828 SCHEMBL810990 | 0.88 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| Chs-828 SCHEMBL16312347 | 0.88 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8918236 | 0.88 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8917545 | 0.88 | IKBKB (0.80) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| Chs-828 SCHEMBL7142976 | 0.87 | IKBKB (0.79) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| Chs-828 SCHEMBL7148798 | 0.87 | IKBKB (0.79) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14324370 | 0.85 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14324372 | 0.85 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2C9CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5696140-A | FOR TREATMENT OF ASTHMA, ALLERGIES, NERVOUS SYSTEM DISORDERS OR CANCER | LEO PHARMACEUTICAL PRODUCTS LTD. (DK) | 1997-12-09 | — | — | US | disclosed |