Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.59 |
| ▸ | NAMPT | P43490 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SCD | O00767 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14212498 | 1.00 | IKBKB (0.59) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8195627 | 0.89 | IKBKB (0.46) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14212497 | 0.88 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14235026 | 0.88 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14212492 | 0.88 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14212503 | 0.88 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14234121 | 0.88 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14212487 | 0.88 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14212486 | 0.88 | IKBKB (0.52) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4693748 | 0.88 | IKBKB (0.57) | IKBKBNAMPTCYP3A4CYP2D6CYP2C9 |
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 |