Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| (Chloromethyl)Benzene SCHEMBL27762297 | 0.98 | FKBP1A (0.41) | FKBP1ASIGMAR1POLBALDH1A1KMT2A | |
| (Chloromethyl)Benzene SCHEMBL467260 | 0.81 | — | — | |
| (Chloromethyl)Benzene SCHEMBL27708420 | 0.81 | — | — | |
| (Chloromethyl)Benzene SCHEMBL28231553 | 0.81 | CALM1 (0.50) | SIGMAR1ALDH1A1TSHRCALM1HPGD | |
| Tetrahydrofuran SCHEMBL8893050 | 0.79 | SIGMAR1 (0.52) | FKBP1ASIGMAR1POLBALDH1A1LMNA | |
| (Chloromethyl)Benzene SCHEMBL10929432 | 0.79 | SIGMAR1 (0.46) | SIGMAR1POLBALDH1A1KMT2ATSHR | |
| (Chloromethyl)Benzene SCHEMBL1616642 | 0.78 | — | — | |
| (Chloromethyl)Benzene SCHEMBL29919724 | 0.78 | — | — | |
| (Chloromethyl)Benzene SCHEMBL29794364 | 0.78 | — | — | |
| SCHEMBL21317609 | 0.78 | CALM1 (0.53) | SIGMAR1ALDH1A1TSHRCALM1HPGD |
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-5539127-A | AROMATASE INHIBITORS | TEIKOKU HORMONE MFG. CO., LTD. (JP) | 1996-07-23 | — | — | US | disclosed |
| CN-1030766-C | Serotonin 5HTIA agonists | MERRELL DOW PHARMA (US) | 1996-01-24 | — | — | CN | disclosed |
| CN-1059717-A | The serotonin stimulant | MERRELL DOW PHARMA (US) | 1992-03-25 | — | — | CN | disclosed |