Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 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 | |
|---|---|---|---|---|
| SCHEMBL11682462 | 0.88 | TSHR (0.42) | HPGDCYP2C9KMT2AMEN1TSHR | |
| SCHEMBL11680641 | 0.86 | CYP2C9 (0.48) | ALDH1A1KDM4EPOLBHPGDCYP2C9 | |
| 3-Chloroaniline SCHEMBL11686685 | 0.85 | SMN1; SMN2 (0.39) | ALDH1A1KDM4EPOLBHPGDRAB9A | |
| SCHEMBL11681974 | 0.80 | CYP2C9 (0.41) | ALDH1A1KDM4EPOLBHPGDRAB9A | |
| SCHEMBL11682158 | 0.78 | TSHR (0.46) | ALDH1A1POLBHPGDCYP2C9TSHR | |
| SCHEMBL11684625 | 0.75 | SENP3 (0.43) | ALDH1A1KDM4ERAB9ACYP2C9KMT2A | |
| SCHEMBL4548023 | 0.75 | RAB9A (0.58) | ALDH1A1KDM4EPOLBHPGDRAB9A | |
| Hydrochloric Acid SCHEMBL27295381 | 0.73 | RAB9A (0.56) | ALDH1A1KDM4EPOLBHPGDRAB9A | |
| SCHEMBL11684152 | 0.73 | TSHR (0.42) | ALDH1A1HPGDCYP2C9KMT2ATSHR | |
| SCHEMBL27716582 | 0.72 | TSHR (0.45) | ALDH1A1KDM4ERAB9AKMT2AMEN1 |
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-4055557-A | MONOAZO DYES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-10-25 | — | — | US | disclosed |