Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | CFD | P00746 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | BLM | P54132 | 2/20 | 0.43 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.43 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.43 |
| ▸ | GGT1 | P19440 | 1/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9318744 | 0.80 | NQO2 (0.50) | ALDH1A1KDM4EGAASMN1; SMN2MAPT | |
| SCHEMBL9453075 | 0.80 | KDM4E (0.37) | ALDH1A1KDM4ETSHRGAARAB9A | |
| SCHEMBL9425118 | 0.78 | ALDH1A1 (0.49) | ALDH1A1KDM4ETSHRGAARAB9A | |
| SCHEMBL1162457 | 0.76 | KDM4E (0.51) | ALDH1A1KDM4ETSHRGAARAB9A | |
| Hydrochloric Acid SCHEMBL1162012 | 0.75 | ALDH1A1 (0.50) | ALDH1A1KDM4ETSHRGAARAB9A | |
| SCHEMBL5789220 | 0.74 | ALDH1A1 (0.62) | ALDH1A1KDM4ETSHRRAB9ASMN1; SMN2 | |
| SCHEMBL6275593 | 0.73 | TNFSF11 (0.67) | ALDH1A1KDM4ETSHRGAARAB9A | |
| SCHEMBL10391840 | 0.70 | ALDH1A1 (0.56) | ALDH1A1KDM4ETSHRSMN1; SMN2MAPT | |
| SCHEMBL9319282 | 0.70 | MAPT (0.56) | ALDH1A1KDM4ETSHRGAASMN1; SMN2 | |
| SCHEMBL10939837 | 0.69 | CFD (0.63) | ALDH1A1KDM4ETSHRGAARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5318963-A | Heterocyclic hydrazide derivatives of monocyclic β-lactam antibiotics | E. R. SQUIBB & SONS, INC. (US) | 1994-06-07 | — | — | US | disclosed |
| EP-0420069-A2 | Heterocyclic hydrazide derivatives of monocyclic beta-lactam antibiotics | E.R. SQUIBB & SONS, INC. (US) | 1991-04-03 | — | — | EP | disclosed |