Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CCR6 | P51684 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 2/20 | 0.36 |
| ▸ | ALPI | P09923 | 2/20 | 0.36 |
| ▸ | VCAM1 | P19320 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | G6PD | P11413 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9734010 | 0.76 | VCAM1 (0.54) | ALDH1A1MAPK1ALPLALPIVCAM1 | |
| SCHEMBL10780936 | 0.76 | ALPL (0.36) | TDP1KMT2AALDH1A1POLBMAPK1 | |
| SCHEMBL11126715 | 0.76 | ALDH1A1 (0.39) | KMT2AALDH1A1POLBMCOLN3ALPL | |
| SCHEMBL6518948 | 0.76 | ALDH1A1 (0.50) | TDP1CCR6CYP1A2KMT2AALDH1A1 | |
| SCHEMBL4745055 | 0.75 | MAPT (0.56) | TDP1CCR6CYP1A2KMT2AALDH1A1 | |
| SCHEMBL11060413 | 0.75 | VCAM1 (0.56) | TDP1KMT2AALDH1A1VCAM1SMN1; SMN2 | |
| SCHEMBL7331747 | 0.73 | TDP1 (0.37) | TDP1CYP1A2KMT2AALDH1A1TSHR | |
| SCHEMBL11681535 | 0.71 | VCAM1 (0.55) | TDP1CCR6CYP1A2KMT2AALDH1A1 | |
| SCHEMBL28302591 | 0.70 | TDP1 (0.45) | TDP1CCR6CYP1A2KMT2AALDH1A1 | |
| SCHEMBL4748223 | 0.70 | TDP1 (0.54) | TDP1CCR6CYP1A2KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0288824-B1 | AROMATIC DIAMINES CONTAINING SULFONIC ACID ESTERS, PROCESS FOR THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF POLYURETHANE POLYMERS | BAYER AG (DE) | 1993-08-25 | — | — | EP | disclosed |
| EP-0288824-A2 | Aromatic diamines containing sulfonic acid esters, process for their preparation and their use for the preparation of polyurethane polymers | BAYER AG (DE) | 1988-11-02 | — | — | EP | disclosed |
| EP-0037029-B1 | PROCESS FOR PREPARING POLYURETHANE ELASTOMERS | BAYER AG (DE) | 1983-10-05 | — | — | EP | disclosed |
| EP-0037030-A1 | Aromatic diamines containing sulphon amide groups | BAYER AG (DE) | 1981-10-07 | — | — | EP | disclosed |