Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | LSS | P48449 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27892992 | 0.84 | TDP1 (0.37) | ALDH1A1TDP1POLBMAPTLMNA | |
| SCHEMBL6599832 | 0.79 | PTGS2 (0.43) | ALDH1A1L3MBTL1TDP1POLBMAPT | |
| SCHEMBL655747 | 0.72 | VCAM1 (0.36) | ALDH1A1L3MBTL1TDP1MAPTLMNA | |
| SCHEMBL7561969 | 0.72 | CYP1A2 (0.54) | ALDH1A1POLBMAPTLMNAKMT2A | |
| SCHEMBL3842501 | 0.72 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1 | |
| SCHEMBL11854424 | 0.71 | MAPT (0.51) | ALDH1A1MAPTLMNAKMT2ARAB9A | |
| SCHEMBL16974732 | 0.71 | SIGMAR1 (0.46) | LMNACHRNB2CHRNA4TSHRCNR2 | |
| SCHEMBL3845913 | 0.71 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1TDP1HPGDTSHR | |
| SCHEMBL2685223 | 0.71 | HTT (0.47) | ALDH1A1L3MBTL1TDP1MAPTLMNA | |
| SCHEMBL4521999 | 0.70 | TDP1 (0.39) | ALDH1A1TDP1POLBMAPTLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4937017-A | Nonlinear optically responsive inorganic-organic composite compositions | HOECHST CELANESE CORP. (US) | 1990-06-26 | — | — | US | disclosed |
| US-4885113-A | Nonlinear optically responsive inorganic-organic composite compositions | HOECHST CELANESE CORPORATION (US) | 1989-12-05 | — | — | US | disclosed |
| EP-0304051-A2 | Nonlinear optically responsive inorganic-organic composite compositions | HOECHST CELANESE CORPORATION (US) | 1989-02-22 | — | — | EP | disclosed |