Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.44 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8880129 | 0.79 | SMN1; SMN2 (0.58) | KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A | |
| SCHEMBL1906823 | 0.78 | IDO1 (0.53) | SMN1; SMN2RAB9AALDH1A1KMT2AMEN1 | |
| SCHEMBL8878334 | 0.75 | SMN1; SMN2 (0.65) | KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A | |
| SCHEMBL5314039 | 0.75 | MEN1 (0.41) | SMN1; SMN2RAB9AALDH1A1KMT2AMEN1 | |
| SCHEMBL5314031 | 0.75 | MEN1 (0.41) | SMN1; SMN2RAB9AALDH1A1KMT2AMEN1 | |
| SCHEMBL212382 | 0.74 | RAB9A (0.68) | KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A | |
| SCHEMBL1995949 | 0.74 | PTGDR2 (0.65) | SMN1; SMN2RAB9APTPN1L3MBTL1POLB | |
| SCHEMBL27339512 | 0.74 | RAB9A (0.59) | KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A | |
| SCHEMBL1435521 | 0.74 | RAB9A (0.59) | KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL8880218 | 0.73 | RAB9A (0.66) | KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A |
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-2007117180-A1 | AZAHETEROCYCLES, COMBINATORY LIBRARY, FOCUSED LIBRARY, PHARMACEUTICAL COMPOSITION AND METHODS FOR THE PRODUCTION THEREOF | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE' LTD. (RU) | 2007-10-18 | — | — | WO | disclosed |