Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | HNF4A | P41235 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11356819 | 0.80 | ALDH1A1 (0.40) | ALDH1A1HSD17B10KDM4EMEN1TP53 | |
| SCHEMBL28219409 | 0.78 | ALDH1A1 (0.38) | ALDH1A1HSD17B10KDM4EMEN1TP53 | |
| SCHEMBL28219447 | 0.78 | CYP2A6 (0.39) | ALDH1A1HSD17B10KDM4EMEN1TP53 | |
| SCHEMBL1089399 | 0.78 | LMNA (0.43) | ALDH1A1HSD17B10MEN1CYP3A4CYP2C9 | |
| SCHEMBL27916062 | 0.76 | ALDH1A1 (0.35) | ALDH1A1HSD17B10MAPTCHRNB2CHRNA4 | |
| SCHEMBL232990 | 0.74 | LMNA (0.41) | ALDH1A1HSD17B10MEN1TP53CYP3A4 | |
| SCHEMBL144652 | 0.74 | FGFR1 (0.47) | HSD17B10CYP3A4MAPTCYP2C19HNF4A | |
| SCHEMBL7324096 | 0.72 | CHRNB2 (0.45) | ALDH1A1HSD17B10KDM4EMEN1TP53 | |
| SCHEMBL6626602 | 0.72 | HSP90AA1 (0.35) | ALDH1A1MAPTCHRNB2CHRNA4P2RX7 | |
| SCHEMBL6629142 | 0.72 | CDC25A (0.39) | ALDH1A1MEN1TP53MAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1068329-C | Metallocenic compound | HOECHST AG (DE) | 2001-07-11 | — | — | CN | disclosed |