Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.76 |
| ▸ | NPC1 | O15118 | 3/20 | 0.68 |
| ▸ | RAB9A | P51151 | 3/20 | 0.68 |
| ▸ | POLB | P06746 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.66 |
| ▸ | MEN1 | O00255 | 1/20 | 0.66 |
| ▸ | LMNA | P02545 | 2/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL243740 | 1.00 | SMN1; SMN2 (0.76) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| Hydrochloric Acid SCHEMBL7607595 | 0.98 | SMN1; SMN2 (0.73) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL7600213 | 0.92 | SMN1; SMN2 (0.65) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL29460273 | 0.86 | SMN1; SMN2 (0.79) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL30522589 | 0.86 | SMN1; SMN2 (1.00) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL18415475 | 0.86 | SMN1; SMN2 (1.00) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL21065524 | 0.86 | SMN1; SMN2 (0.79) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL4743413 | 0.85 | SMN1; SMN2 (0.57) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL16517129 | 0.85 | SMN1; SMN2 (0.83) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL10402199 | 0.85 | SMN1; SMN2 (0.76) | SMN1; SMN2NPC1RAB9APOLBALDH1A1 |
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-116528858-A | Multi-heterocycle small molecule drug conjugate and application thereof | 台湾卫生研究院 | 2023-08-01 | — | — | CN | disclosed |