Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 11/20 | 0.41 |
| ▸ | NPC1 | O15118 | 10/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.39 |
| ▸ | RELA | Q04206 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | CASP3 | P42574 | 2/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29218796 | 0.97 | RAB9A (0.44) | SMYD3RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL29218628 | 0.81 | RAB9A (0.44) | SMYD3RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL29218863 | 0.81 | HSP90AA1 (0.34) | LMNA | |
| SCHEMBL29218859 | 0.81 | SYK (0.39) | RAB9ANPC1SMN1; SMN2TP53NFKB1 | |
| SCHEMBL29218624 | 0.81 | RORC (0.34) | SMN1; SMN2CYP1A2CYP3A4CYP2C19KMT2A | |
| SCHEMBL29218593 | 0.80 | KCNQ3 (0.47) | RAB9ANPC1SMN1; SMN2HPGDKMT2A | |
| SCHEMBL29218644 | 0.78 | GFER (0.45) | RAB9ANPC1HTTLMNAGAA | |
| SCHEMBL31206001 | 0.78 | SMYD3 (0.50) | SMYD3RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL29218716 | 0.77 | ALDH1A1 (0.43) | RAB9ANPC1LMNAGAA | |
| SCHEMBL25039664 | 0.77 | SMYD3 (0.55) | SMYD3RAB9ANPC1SMN1; SMN2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-118076581-A | Iron death modulators, their preparation and use | 维泰瑞隆有限公司 | 2024-05-24 | — | — | CN | disclosed |