Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10891573 | 0.79 | ALDH1A1 (0.33) | ALDH1A1KDM4EGAAMAPTLMNA | |
| SCHEMBL10889389 | 0.79 | ESR1 (0.37) | ALDH1A1TP53KDM4EGAAMAPT | |
| Hydrochloric Acid SCHEMBL10899309 | 0.74 | RAB9A (0.35) | CYP3A4LMNASIGMAR1SMN1; SMN2 | |
| SCHEMBL10891976 | 0.73 | SIGMAR1 (0.40) | ALDH1A1KDM4EGAAMAPTCYP3A4 | |
| SCHEMBL10897182 | 0.71 | EPHX2 (0.32) | KDM4E | |
| SCHEMBL6090311 | 0.69 | CA12 (0.50) | ALDH1A1KDM4EGAAMAPTPOLB | |
| SCHEMBL9801011 | 0.69 | ALDH1A1 (0.43) | ALDH1A1TP53KDM4EGAAMAPT | |
| SCHEMBL6090307 | 0.69 | CA12 (0.50) | ALDH1A1KDM4EGAAMAPTPOLB | |
| SCHEMBL8859049 | 0.69 | CA12 (0.46) | ALDH1A1KDM4EGAAMAPTLMNA | |
| SCHEMBL10988376 | 0.69 | ALDH1A1 (0.48) | ALDH1A1TP53KDM4EGAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4612395-A | Process for the production of N-(2-methyl-4-chlorophenyl)-formamidine derivatives | CIBA-GEIGY CORPORATION (US) | 1986-09-16 | — | — | US | disclosed |