Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ATP6V1B2 | P21281 | 1/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
| ▸ | EDNRA | P25101 | 1/20 | 0.43 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TOP1 | P11387 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8941913 | 0.93 | LMNA (0.51) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8942358 | 0.91 | ALDH1A1 (0.45) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8942224 | 0.91 | ALDH1A1 (0.48) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8942081 | 0.91 | ALDH1A1 (0.44) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8942032 | 0.90 | DRD3 (0.41) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| Water SCHEMBL8942061 | 0.90 | DRD3 (0.40) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8941921 | 0.89 | ALDH1A1 (0.46) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8942006 | 0.87 | LMNA (0.49) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8941949 | 0.87 | TOP1 (0.39) | ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R | |
| SCHEMBL8942126 | 0.86 | KDM4E (0.49) | ALDH1A1LMNACYP2C9KDM4EHPGD |
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-5556861-A | 1,8 benzonaphthyridine derivatives and antimicrobial compositions | LABORATOIRE ROGER BELLON (FR) | 1996-09-17 | — | — | US | disclosed |