Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SNCA | P37840 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALB | P02768 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.34 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.34 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9256181 | 1.00 | ALDH1A1 (0.40) | ALDH1A1TSHRTDP1HTTSMN1; SMN2 | |
| SCHEMBL9268690 | 0.88 | MAPT (0.43) | ALDH1A1TDP1HTTSMN1; SMN2SNCA | |
| SCHEMBL9268700 | 0.88 | MAPT (0.43) | ALDH1A1TDP1HTTSMN1; SMN2SNCA | |
| SCHEMBL9515918 | 0.80 | NFE2L2 (0.52) | ALDH1A1TDP1HTTMAPTMEN1 | |
| SCHEMBL5776476 | 0.80 | NFE2L2 (0.52) | ALDH1A1TDP1HTTMAPTMEN1 | |
| SCHEMBL17199072 | 0.70 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1HTTSMN1; SMN2 | |
| SCHEMBL25540567 | 0.69 | ALDH1A1 (0.53) | ALDH1A1TSHRTDP1HTTCYP3A4 | |
| SCHEMBL16971227 | 0.69 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1HTTSMN1; SMN2 | |
| SCHEMBL16971225 | 0.69 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1HTTSMN1; SMN2 | |
| SCHEMBL11212736 | 0.68 | NFE2L2 (0.61) | ALDH1A1TSHRTDP1SNCACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5399702-A | Leukotriene antagonists; antiasthmatic, antiallergen, and antianaphylactic agents | HOFFMANN-LA ROCHE INC. (US) | 1995-03-21 | — | — | US | disclosed |
| EP-0577003-A1 | Thiazolylvinylphenyl derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1994-01-05 | — | — | EP | disclosed |
| US-5273986-A | A substituted phenylalkyleneamidophenyleneethylene thiazole | HOFFMANN-LA ROCHE INC. (US) | 1993-12-28 | — | — | US | disclosed |