Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24587500 | 1.00 | ALDH1A1 (0.44) | ALDH1A1TSHRTBXAS1LMNAKDM4E | |
| SCHEMBL9049685 | 0.84 | TSHR (0.50) | ALDH1A1TSHRLMNAKDM4EGMNN | |
| SCHEMBL9049678 | 0.84 | TSHR (0.50) | ALDH1A1TSHRLMNAKDM4EGMNN | |
| SCHEMBL11829415 | 0.82 | NFKB1 (0.46) | ALDH1A1TBXAS1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL12498707 | 0.81 | HSD11B1 (0.44) | TBXAS1LMNAKDM4ECYP3A4CYP2C9 | |
| SCHEMBL5179024 | 0.81 | TBXAS1 (0.40) | TBXAS1LMNAKDM4ECYP3A4CYP2C9 | |
| SCHEMBL3377294 | 0.81 | CYP1A2 (0.50) | ALDH1A1TBXAS1LMNASMN1; SMN2CYP3A4 | |
| SCHEMBL12498711 | 0.81 | HSD11B1 (0.44) | TBXAS1LMNAKDM4ECYP3A4CYP2C9 | |
| SCHEMBL16795914 | 0.81 | TRPA1 (0.47) | ALDH1A1TBXAS1LMNASMN1; SMN2KMT2A | |
| SCHEMBL9390821 | 0.81 | TRPA1 (0.47) | ALDH1A1TBXAS1LMNASMN1; SMN2KMT2A |
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-6211197-B1 | CARBOXYLIC ACID OR TETRAZOLE DERIVATES; ANALGESICS, ANTIPYRETICS, AND ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION | MERCK FROSST CANADA & CO. (CA) | 2001-04-03 | — | — | US | disclosed |