Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | TLR2 | O60603 | 1/20 | 0.45 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.45 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.45 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11411252 | 1.00 | TSHR (0.53) | TSHRMAPK1ALDH1A1TLR2TLR1 | |
| SCHEMBL11402270 | 0.89 | ALDH1A1 (0.52) | TSHRALDH1A1TLR2TLR1TLR6 | |
| SCHEMBL11405780 | 0.88 | TSHR (0.53) | TSHRMAPK1ALDH1A1TLR2TLR1 | |
| SCHEMBL11405776 | 0.88 | TSHR (0.53) | TSHRMAPK1ALDH1A1TLR2TLR1 | |
| SCHEMBL11404742 | 0.86 | TLR2 (0.55) | TSHRMAPK1ALDH1A1TLR2TLR1 | |
| SCHEMBL11410278 | 0.86 | TLR2 (0.55) | TSHRMAPK1ALDH1A1TLR2TLR1 | |
| SCHEMBL11404055 | 0.83 | PTGS2 (0.53) | TSHRALDH1A1TLR2TLR1TLR6 | |
| SCHEMBL11424615 | 0.81 | ALDH1A1 (0.46) | TSHRALDH1A1TLR2TLR1TLR6 | |
| SCHEMBL11424611 | 0.81 | ALDH1A1 (0.46) | TSHRALDH1A1TLR2TLR1TLR6 | |
| SCHEMBL11428155 | 0.81 | CA12 (0.46) | ALDH1A1LMNAL3MBTL1KMT2AKDM4E |
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-4200648-A | INFLAMMATION BY ADMINISTERING A BENZYLIDENEANILINE DERIVATIVE | WILLIAM H. RORER, INC. (US) | 1980-04-29 | — | — | US | disclosed |
| US-4198349-A | ANTIINFLAMMATORY, TOPICAL | WILLIAM H. RORER, INC. (US) | 1980-04-15 | — | — | US | disclosed |