Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.49 |
| ▸ | HTR2C | P28335 | 2/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 8/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | BLM | P54132 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30234578 | 0.89 | POLB (0.52) | POLBRAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL23867477 | 0.89 | POLB (0.52) | POLBRAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL23867515 | 0.85 | POLB (0.47) | HTR2AHTR2CSRCPOLBRAB9A | |
| SCHEMBL23867574 | 0.85 | PYGM (0.53) | HTR2AHTR2CSRCDRD3HPGD | |
| SCHEMBL23867479 | 0.83 | POLB (0.49) | POLBRAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL23867474 | 0.82 | SRC (0.51) | HTR2AHTR2CSRCPOLBRAB9A | |
| SCHEMBL23867514 | 0.80 | POLB (0.50) | HTR2ASRCPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL23867522 | 0.76 | HTR2A (0.53) | HTR2AHTR2CSRCDRD3 | |
| SCHEMBL30234726 | 0.74 | POLB (0.51) | POLBRAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL23867516 | 0.74 | POLB (0.53) | POLBRAB9ASMN1; SMN2NPC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021195279-A2 | SMALL MOLECULE INHIBITORS OF ONCOGENIC CHD1L WITH PRECLINICAL ACTIVITY AGAINST COLORECTAL CANCER | THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) | 2021-09-30 | — | — | WO | disclosed |