Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | BRD2 | P25440 | 1/20 | 0.50 |
| ▸ | INMT | O95050 | 3/20 | 0.38 |
| ▸ | PER2 | O15055 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL82580 | 0.97 | — | — | |
| Fluoride SCHEMBL20741987 | 0.94 | BRD4 (0.50) | BRD4BRD2INMTPER2KMT2A | |
| Bromide SCHEMBL7186245 | 0.94 | BRD4 (0.50) | BRD4BRD2INMTPER2KMT2A | |
| SCHEMBL8272670 | 0.90 | BRD4 (0.52) | BRD4BRD2INMTPER2KMT2A | |
| Cyclohexane SCHEMBL5696269 | 0.90 | BRD4 (0.46) | BRD4BRD2INMTKMT2APIK3CD | |
| SCHEMBL3043 | 0.90 | — | — | |
| SCHEMBL2398125 | 0.90 | BRD4 (0.43) | BRD4BRD2INMTKMT2APIK3CD | |
| Benzene SCHEMBL7856891 | 0.88 | BRD4 (0.46) | BRD4BRD2INMTPER2KMT2A | |
| Water SCHEMBL3778195 | 0.87 | — | — | |
| Lithium SCHEMBL31009372 | 0.87 | — | — |
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-20110004017-A1 | METHOD FOR PRODUCING B-MERCAPTOCARBOXYLIC ACIDS | SHOWA DENKO K.K. (JP) | 2011-01-06 | — | — | US | disclosed |
| US-5268380-A | Therapy for keratinization in mammals | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-12-07 | — | — | US | disclosed |
| US-5185346-A | Antiandrogenic agents; suppress elimination of retinoids; anticarcinogenic agents | HANSSEN PHARMACEUTICA (BE) | 1993-02-09 | — | — | US | disclosed |
| US-5028606-A | Retinoid metabolism inhibitors | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-07-02 | — | — | US | disclosed |