Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | ALPL | P05186 | 3/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6828049 | 0.89 | ALDH1A1 (0.62) | ALDH1A1ALPLGLACYP3A4MAPT | |
| SCHEMBL6929713 | 0.88 | ALDH1A1 (0.60) | ALDH1A1ALPLGLACYP3A4MAPT | |
| SCHEMBL6925877 | 0.86 | ALDH1A1 (0.58) | ALDH1A1GLACYP3A4MAPTCYP2C9 | |
| SCHEMBL3069113 | 0.76 | ALDH1A1 (0.60) | ALDH1A1GLACYP3A4MAPTCYP2C9 | |
| SCHEMBL6929296 | 0.75 | ALDH1A1 (0.58) | ALDH1A1GLACYP3A4MAPTCYP2C9 | |
| SCHEMBL6827768 | 0.73 | ALDH1A1 (0.57) | ALDH1A1GLACYP3A4MAPTCYP2C9 | |
| SCHEMBL6925065 | 0.73 | ALDH1A1 (0.57) | ALDH1A1GLACYP3A4MAPTCYP2C9 | |
| SCHEMBL6827973 | 0.73 | PKM (0.61) | ALDH1A1PKMLMNAPOLBRAB9A | |
| SCHEMBL6925728 | 0.73 | ALDH1A1 (0.56) | ALDH1A1GLACYP3A4MAPTCYP2C9 | |
| SCHEMBL6830937 | 0.72 | ALDH1A1 (0.60) | ALDH1A1GLACYP3A4MAPTCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004073619-A2 | CCR8 ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-09-02 | — | — | WO | claimed |
| WO-2004073619-A2 | CCR8 ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-09-02 | — | — | WO | disclosed |