Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 7/20 | 0.39 |
| ▸ | RIN1 | Q13671 | 7/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TNF | P01375 | 10/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.34 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10654203 | 0.85 | ABL1 (0.37) | ABL1RIN1ALDH1A1TNFTDP1 | |
| SCHEMBL10656393 | 0.79 | HPGD (0.39) | ABL1RIN1ALDH1A1TDP1TSHR | |
| SCHEMBL10652782 | 0.71 | ABL1 (0.39) | ABL1RIN1ALDH1A1TNFTDP1 | |
| SCHEMBL5228776 | 0.70 | TRPA1 (0.33) | — | |
| SCHEMBL282083 | 0.66 | CYP1A2 (0.61) | ALDH1A1TDP1TSHRL3MBTL1CYP1A2 | |
| SCHEMBL50610 | 0.66 | CYP1A2 (0.73) | ALDH1A1TDP1TSHRL3MBTL1CYP1A2 | |
| SCHEMBL8570508 | 0.66 | CYP1A2 (0.73) | ALDH1A1TDP1TSHRL3MBTL1CYP1A2 | |
| SCHEMBL24597734 | 0.65 | CYP1A2 (0.59) | ALDH1A1TDP1TSHRCYP1A2KMT2A | |
| SCHEMBL52706 | 0.65 | CYP1A2 (0.59) | ALDH1A1TDP1TSHRCYP1A2KMT2A | |
| SCHEMBL7034021 | 0.65 | CYP1A2 (0.59) | ALDH1A1TDP1TSHRL3MBTL1CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4782165-A | BUNTE SALT | PFIZER INC. (US) | 1988-11-01 | — | — | US | disclosed |
| US-4709044-A | IMIDAZOLES | PFIZER INC. (US) | 1987-11-24 | — | — | US | disclosed |
| WO-1986002069-A1 | BIOTIN INTERMEDIATES AND PROCESS THEREFOR | PFIZER INC. (US) | 1986-04-10 | — | — | WO | disclosed |
| WO-1986002070-A1 | A PROCESS FOR PREPARING 4-METHYL-4-IMIDAZOLIN-2-ONE AND DERIVATIVES THEREOF | PFIZER INC. (US) | 1986-04-10 | — | — | WO | disclosed |