Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.37 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.37 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.37 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.37 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.37 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7981878 | 0.89 | LMNA (0.57) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8802499 | 0.85 | LMNA (0.44) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7977502 | 0.84 | CYP1A2 (0.53) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7967602 | 0.81 | CACNB4 (0.39) | LMNAALDH1A1ACHECACNB4CACNA1A | |
| SCHEMBL7981180 | 0.80 | CACNB4 (0.38) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8802939 | 0.80 | LMNA (0.47) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8804101 | 0.80 | LMNA (0.46) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7979243 | 0.74 | CACNB4 (0.38) | LMNAALDH1A1ACHECACNB4CACNA1A | |
| SCHEMBL10748512 | 0.73 | SMN1; SMN2 (0.42) | LMNAALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL7967452 | 0.73 | CYP1A2 (0.55) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 |
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-6194428-B1 | BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-02-27 | — | — | US | claimed |
| US-6194428-B1 | BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-02-27 | — | — | US | disclosed |