Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3913442 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TDP1L3MBTL1KMT2ANPC1 | |
| SCHEMBL1131161 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TDP1L3MBTL1HPGDKMT2A | |
| SCHEMBL1131530 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TDP1L3MBTL1HPGDKMT2A | |
| Hydrochloric Acid SCHEMBL11758129 | 0.84 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1HPGDKMT2A | |
| Hydrochloric Acid SCHEMBL11758133 | 0.84 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1HPGDKMT2A | |
| SCHEMBL25044629 | 0.80 | CA2 (0.48) | ALDH1A1TDP1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL5638935 | 0.77 | TSHR (0.58) | ALDH1A1TDP1L3MBTL1KMT2ANPC1 | |
| SCHEMBL2088309 | 0.77 | TDP1 (0.71) | ALDH1A1TDP1L3MBTL1HPGDKMT2A | |
| SCHEMBL7159716 | 0.77 | ALDH1A1 (0.71) | ALDH1A1TDP1L3MBTL1KMT2ANPC1 | |
| SCHEMBL31119225 | 0.77 | TDP1 (0.71) | ALDH1A1TDP1L3MBTL1HPGDKMT2A |
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-1998002420-A1 | CERTAIN FUSED PYRROLECARBOXANILIDES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 1998-01-22 | — | — | WO | disclosed |