Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | PLEC | Q15149 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL497784 | 0.93 | AKR1C3 (0.65) | AKR1C3ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| Phenol SCHEMBL27737069 | 0.86 | AKR1C3 (0.60) | AKR1C3ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| Isophthalic Acid SCHEMBL27361534 | 0.85 | AKR1C3 (0.58) | AKR1C3ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3855096 | 0.84 | AKR1C3 (0.58) | AKR1C3POLBALDH1A1NPC1RAB9A | |
| SCHEMBL31480233 | 0.81 | AKR1C3 (0.55) | AKR1C3POLBALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL873032 | 0.80 | AKR1C3 (0.61) | AKR1C3ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8285571 | 0.80 | KMT2A (0.59) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL9231035 | 0.79 | NR1H4 (0.56) | AKR1C3ALDH1A1NR1H4 | |
| SCHEMBL4191220 | 0.79 | LMNA (0.59) | AKR1C3POLBALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL6330083 | 0.78 | HDAC11 (0.58) | AKR1C3ALDH1A1NR1H4HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105709242-B | A method of zebra fish gastrointestinal tract is marked using calcein | 山东省科学院生物研究所 | 2018-10-26 | — | — | CN | disclosed |
| US-5925528-A | Murine cell lines which over produce acidic fibroblast growth factor (aFGF) and method of using same | OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 1999-07-20 | — | — | US | disclosed |
| US-5750365-A | Isolated nucleic acid encoding a newt acidic fibroblast growth factor (AFGF) | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 1998-05-12 | — | — | US | disclosed |