Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.59 |
| ▸ | ELANE | P08246 | 4/20 | 0.55 |
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.50 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.50 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7938401 | 0.92 | ESR1 (0.68) | ALDH1A1SRD5A2ELANEESR1CYP3A4 | |
| SCHEMBL7940672 | 0.91 | HPGD (0.51) | ALDH1A1SRD5A2ELANEESR1CYP3A4 | |
| Bisphenol A SCHEMBL5053970 | 0.90 | ESR1 (0.70) | ALDH1A1SRD5A2ELANEESR1CYP3A4 | |
| SCHEMBL10930836 | 0.89 | SRD5A2 (0.61) | SRD5A2ELANEL3MBTL1TDP1MAPT | |
| SCHEMBL195282 | 0.87 | SRD5A2 (0.77) | ALDH1A1SRD5A2ELANERAB9ANPC1 | |
| SCHEMBL677046 | 0.87 | ALDH1A1 (0.61) | ALDH1A1SRD5A2ELANERAB9ANPC1 | |
| SCHEMBL15828750 | 0.86 | ELANE (0.64) | SRD5A2ELANENPC1L3MBTL1TDP1 | |
| SCHEMBL17879954 | 0.85 | SRD5A2 (0.66) | SRD5A2ELANERAB9ANPC1 | |
| SCHEMBL10334166 | 0.85 | SRD5A2 (0.61) | ALDH1A1SRD5A2ELANEESR1CYP3A4 | |
| SCHEMBL547672 | 0.85 | ALDH1A1 (0.58) | ALDH1A1SRD5A2ELANERAB9ANPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4205016-A | Multifunctional lithium containing initiator | THE DOW CHEMICAL COMPANY (US) | 1980-05-27 | — | — | US | disclosed |
| US-4201729-A | CONTAINING BUTADIENE AND/OR ISOPRENE UNITS | THE DOW CHEMICAL COMPANY (US) | 1980-05-06 | — | — | US | disclosed |
| US-4200718-A | Multifunctional lithium containing initiator | THE DOW CHEMICAL COMPANY (US) | 1980-04-29 | — | — | US | disclosed |