Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.81 |
| ▸ | TSHR | P16473 | 2/20 | 0.81 |
| ▸ | MEN1 | O00255 | 7/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.64 |
| ▸ | GPR27 | Q9NS67 | 2/20 | 0.60 |
| ▸ | PGR | P06401 | 3/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | ACLY | P53396 | 1/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.52 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11584745 | 0.85 | KMT2A (0.60) | ALDH1A1TSHRMEN1KMT2APKM | |
| SCHEMBL11583053 | 0.83 | MEN1 (0.59) | ALDH1A1TSHRMEN1KMT2AGPR27 | |
| SCHEMBL664321 | 0.83 | KMT2A (0.75) | ALDH1A1TSHRMEN1KMT2AGPR27 | |
| SCHEMBL8251165 | 0.82 | PFKFB3 (0.67) | ALDH1A1TSHRMEN1KMT2APGR | |
| SCHEMBL9997096 | 0.81 | ALDH1A1 (0.69) | ALDH1A1TSHRPGRPKMACLY | |
| SCHEMBL11585563 | 0.80 | CASP3 (0.64) | ALDH1A1TSHRMEN1KMT2APGR | |
| SCHEMBL11585081 | 0.80 | MCL1 (0.60) | ALDH1A1TSHRMEN1KMT2AGPR27 | |
| SCHEMBL29369447 | 0.79 | PFKFB3 (0.71) | ALDH1A1TSHRMEN1KMT2APGR | |
| SCHEMBL2831061 | 0.79 | PFKFB3 (0.71) | ALDH1A1TSHRMEN1KMT2APGR | |
| SCHEMBL29875309 | 0.79 | PFKFB3 (0.71) | ALDH1A1TSHRMEN1KMT2APGR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4101551-A | WATER INSOLUBILITY, AFFINITY FOR POLYESTERS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-07-18 | — | — | US | disclosed |