Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Triphenylphosphine Oxide SCHEMBL6743727 | 0.77 | MEN1 (0.64) | MEN1KMT2APOLBTSHRSMN1; SMN2 | |
| SCHEMBL362216 | 0.75 | TSHR (0.37) | MEN1KMT2APOLBTSHRALDH1A1 | |
| SCHEMBL6677591 | 0.73 | NPC1 (0.49) | MEN1KMT2ATSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL362355 | 0.72 | CA2 (0.44) | MEN1KMT2APOLBTSHRALDH1A1 | |
| SCHEMBL283224 | 0.72 | ALDH1A1 (0.51) | MEN1KMT2ATSHRSMN1; SMN2ALDH1A1 | |
| Toluene SCHEMBL717525 | 0.72 | TSHR (0.48) | MEN1KMT2APOLBTSHRSMN1; SMN2 | |
| Toluene SCHEMBL717526 | 0.72 | TSHR (0.48) | MEN1KMT2APOLBTSHRSMN1; SMN2 | |
| SCHEMBL15873731 | 0.70 | MEN1 (0.56) | MEN1KMT2APOLBTSHRSMN1; SMN2 | |
| SCHEMBL423343 | 0.69 | TSHR (0.46) | MEN1KMT2APOLBTSHRSMN1; SMN2 | |
| SCHEMBL11588325 | 0.69 | MEN1 (0.50) | MEN1KMT2APOLBTSHRSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0607400-B1 | Fluorinated 17-beta substituted-4-aza-5-alpha- andostran-3one derivatives. | PHARMACIA & UPJOHN SPA (IT) | 1997-11-05 | — | — | EP | disclosed |
| US-5407939-A | Inhibitors of androgen action by means of testosterone 5alpha-reductase inhibition | FARMITALIA CARLO ERBA S.R.L. (IT) | 1995-04-18 | — | — | US | disclosed |
| WO-1994003475-A1 | FLUORINATED 17β-SUBSTITUTED 4-AZA-5α-ANDROSTAN-3-ONE DERIVATIVES | FARMITALIA CARLO ERBA S.R.L. (IT) | 1994-02-17 | — | — | WO | disclosed |