Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UNG | P13051 | 1/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | KDM6B | O15054 | 1/20 | 0.54 |
| ▸ | KDM5C | P41229 | 1/20 | 0.54 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.54 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.54 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.54 |
| ▸ | P4HB | P07237 | 3/20 | 0.52 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.52 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.52 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.52 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.52 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.52 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.52 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.51 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.51 |
| ▸ | ERN1 | O75460 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29677467 | 0.93 | ALDH1A1 (0.61) | UNGALDH1A1P4HBGRIN2DGRIN3B | |
| SCHEMBL47068 | 0.93 | ALDH1A1 (0.61) | UNGALDH1A1P4HBGRIN2DGRIN3B | |
| Benzaldehyde SCHEMBL28453973 | 0.92 | UNG (0.62) | UNGALDH1A1KDM4EKDM6BKDM5C | |
| 3-Formylbenzoic Acid SCHEMBL29514486 | 0.86 | UNG (1.00) | UNGALDH1A1KDM4EP4HBTSHR | |
| 3-Formylbenzoic Acid SCHEMBL266698 | 0.86 | UNG (1.00) | UNGALDH1A1KDM4EP4HBTSHR | |
| 3,4-Dimethoxybenzaldehyde SCHEMBL28182010 | 0.84 | ALDH1A1 (0.58) | UNGALDH1A1KDM4ETSHRERN1 | |
| 3-Formylbenzoic Acid SCHEMBL2278527 | 0.84 | UNG (0.96) | UNGALDH1A1KDM4EP4HBTRIM24 | |
| SCHEMBL30262601 | 0.84 | KDM4E (0.66) | ALDH1A1KDM4EKDM6BKDM5CKDM4C | |
| 3-Formylbenzoic Acid SCHEMBL27872652 | 0.84 | UNG (0.96) | UNGALDH1A1KDM4EP4HBTSHR | |
| SCHEMBL39797 | 0.84 | KDM4E (0.66) | ALDH1A1KDM4EKDM6BKDM5CKDM4C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1392643-A2 | TRISUBSTITUTED-N- (1S)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL] BENZAMIDES WHICH INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS | Abbott Laboratories (US) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002094767-A2 | TRISUBSTITUTED-N-[(1S)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL] BENZAMIDES WHICH INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS | ABBOTT LABORATORIES (US) | 2002-11-28 | — | — | WO | disclosed |